A0A3Q0KGV6_SCHMA Loading...

Neurotransmitter-gated ion-channel ligand-binding domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KGV6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 677 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.4	Very low	50.9	Low	223 Å²	223	151.1 Å²	151.1	100%	1.099	72%	0.721	S	S	*	*				0	-53.6	0	-155.9	161.4	-178.3	0	0	113.1	V3 N4	M1-V3 PolarHBondContact O-N 3.05Å; M1-N4 PolarHBondContact O-N 3.21Å
2	W	45.7	Very low	51	Low	237 Å²	237	152.5 Å²	152.5	90%	0.898	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-37.2	-173.4	-85.9	65	0	0	0	116.7	N4 V5	W2-N4 VanDerWaalsContact C-N 3.3Å; W2-N4 PolarHBondContact O-N 3.3Å; W2-V5 PolarHBondContact O-N 3.49Å; W2-V5 VanDerWaalsContact O-N 3.1Å
3	V	49.4	Very low	51.4	Low	117 Å²	117	151.3 Å²	151.3	71%	0.709	72%	0.718	S	S	*	*	H	α-helix	trans	-57	-37.6	-174.6	-178.8	0	0	0	0	113.3	M1 V5 M6	M1-V3 PolarHBondContact O-N 3.05Å; V3-V5 PolarHBondContact O-N 3.46Å; V3-M6 PolarHBondContact O-N 3.16Å
4	N	50.6	Low	51.6	Low	128 Å²	128	143.5 Å²	143.5	68%	0.684	70%	0.698	S	S	*	*	H	α-helix	trans	-71.6	-7	-178.3	-92.7	-10.4	0	0	0	114.8	M1 W2	M1-N4 PolarHBondContact O-N 3.21Å; W2-N4 VanDerWaalsContact C-N 3.3Å; W2-N4 PolarHBondContact O-N 3.3Å
5	V	53.6	Low	52	Low	101 Å²	101	143.8 Å²	143.8	61%	0.612	69%	0.694	S	S	*	*	H	α-helix	trans	-86.8	-32.6	176.2	-175.3	0	0	0	0	111.3	W2 V3	W2-V5 PolarHBondContact O-N 3.49Å; W2-V5 VanDerWaalsContact O-N 3.1Å; V3-V5 PolarHBondContact O-N 3.46Å
6	M	50.4	Low	52.6	Low	130 Å²	130	140.9 Å²	140.9	64%	0.64	68%	0.683	S	S	*	*	H	α-helix	trans	-68.2	-47.3	178.3	-83.3	-66.9	-161.9	0	0	112.4	V3 K8 R9 F10	V3-M6 PolarHBondContact O-N 3.16Å; M6-K8 VanDerWaalsContact C-N 3.32Å; M6-K8 PolarHBondContact O-N 3.18Å; M6-R9 PolarHBondContact O-N 3.45Å; M6-F10 PolarHBondContact O-N 3.28Å
7	T	53.5	Low	53.5	Low	76 Å²	76	139.6 Å²	139.6	47%	0.466	68%	0.679	S	S	.	*	H	α-helix	trans	-60.1	-38.5	-177.3	42.7	0	0	0	0	112.8	R9 F10 I11	T7-R9 VanDerWaalsContact C-N 3.29Å; T7-R9 PolarHBondContact O-N 2.91Å; T7-F10 PolarHBondContact O-N 3.29Å; T7-I11 PolarHBondContact O-N 3.11Å
8	K	51.7	Low	54.3	Low	172 Å²	172	141.4 Å²	141.4	75%	0.748	68%	0.679	S	S	*	*	H	α-helix	trans	-67.7	-20.8	175	-84.6	-171.3	172.6	-177.3	0	114.6	M6	M6-K8 VanDerWaalsContact C-N 3.32Å; M6-K8 PolarHBondContact O-N 3.18Å
9	R	51.7	Low	55.1	Low	196 Å²	196	137.6 Å²	137.6	74%	0.74	66%	0.662	S	S	*	*	H	α-helix	trans	-79.7	-42.5	172.7	-83.2	-172.7	168.4	-175.9	-3.2	112.4	M6 T7 I11 K12 M13	M6-R9 PolarHBondContact O-N 3.45Å; T7-R9 VanDerWaalsContact C-N 3.29Å; T7-R9 PolarHBondContact O-N 2.91Å; R9-I11 PolarHBondContact O-N 3.13Å; R9-K12 PolarHBondContact O-N 2.66Å; R9-M13 PolarHBondContact O-N 3.45Å
10	F	50.2	Low	56	Low	152 Å²	152	135.8 Å²	135.8	67%	0.667	66%	0.655	S	S	*	*	H	α-helix	trans	-62.6	-43.4	-178.5	-91.5	-84.8	0	0	0	113.5	M6 T7 K12 M13 G14	M6-F10 PolarHBondContact O-N 3.28Å; T7-F10 PolarHBondContact O-N 3.29Å; F10-K12 PolarHBondContact O-N 2.95Å; F10-M13 PolarHBondContact O-N 3.28Å; F10-M13 VanDerWaalsContact O-N 3.08Å; F10-G14 PolarHBondContact O-N 2.94Å
11	I	53.9	Low	56.6	Low	130 Å²	130	132.7 Å²	132.7	67%	0.667	65%	0.647	S	S	*	*	H	α-helix	trans	-58.2	-35.3	178	-63.9	168.9	0	0	0	111.3	T7 R9 M13 F15	T7-I11 PolarHBondContact O-N 3.11Å; R9-I11 PolarHBondContact O-N 3.13Å; I11-M13 VanDerWaalsContact C-N 3.34Å; I11-M13 PolarHBondContact O-N 3.34Å; I11-F15 PolarHBondContact O-N 3.03Å
12	K	52.2	Low	57.5	Low	168 Å²	168	124.7 Å²	124.7	73%	0.73	61%	0.611	S	S	*	*	H	α-helix	trans	-77	-16	-178.8	-152	171.9	-174.3	-179.9	0	113.9	R9 F10	R9-K12 PolarHBondContact O-N 2.66Å; F10-K12 PolarHBondContact O-N 2.95Å
13	M	55.7	Low	58.6	Low	137 Å²	137	120 Å²	120	68%	0.675	60%	0.597	S	S	*	*	H	α-helix	trans	-81.9	-43.6	169.3	-89.8	179.4	156.5	0	0	112.2	R9 F10 I11 F15 N16 I17	R9-M13 PolarHBondContact O-N 3.45Å; F10-M13 PolarHBondContact O-N 3.28Å; F10-M13 VanDerWaalsContact O-N 3.08Å; I11-M13 VanDerWaalsContact C-N 3.34Å; I11-M13 PolarHBondContact O-N 3.34Å; M13-F15 VanDerWaalsContact C-N 3.3Å; M13-F15 PolarHBondContact O-N 2.9Å; M13-N16 PolarHBondContact O-N 3.14Å; M13-I17 PolarHBondContact O-N 3.03Å
14	G	54.5	Low	59.7	Low	42 Å²	42	119 Å²	119	43%	0.433	59%	0.587	S	S	.	*	H	α-helix	trans	-58.7	-38.8	-178.7	0	0	0	0	0	113.6	F10 N16 I17 Y18	F10-G14 PolarHBondContact O-N 2.94Å; G14-N16 PolarHBondContact O-N 2.98Å; G14-I17 PolarHBondContact O-N 3.29Å; G14-Y18 PolarHBondContact O-N 3.38Å
15	F	57.3	Low	60.4	Low	148 Å²	148	116.3 Å²	116.3	65%	0.649	58%	0.578	S	S	*	*	H	α-helix	trans	-64.3	-38	-178.8	-154.2	-103.9	0	0	0	113.3	I11 M13 Y18 I19	I11-F15 PolarHBondContact O-N 3.03Å; M13-F15 VanDerWaalsContact C-N 3.3Å; M13-F15 PolarHBondContact O-N 2.9Å; F15-Y18 PolarHBondContact O-N 3.13Å; F15-I19 HydrophobicContact CD1-CD1 3.72Å; F15-I19 HydrophobicContact CD1-CG1 4.48Å; F15-I19 HydrophobicContact CE1-CD1 3.76Å; F15-I19 HydrophobicContact CE1-CG1 4.48Å; F15-I19 WeakPolarHBondContact O-CG1 3.43Å; F15-I19 PolarHBondContact O-N 3.35Å; F15-I19 VanDerWaalsContact O-N 3.13Å
16	N	61.4	Low	60.7	Low	97 Å²	97	116.5 Å²	116.5	52%	0.519	58%	0.575	S	S	.	*	H	α-helix	trans	-67.5	-38.4	176.1	-86.1	-26.5	0	0	0	112.4	M13 G14 Y18 I19 I20	M13-N16 PolarHBondContact O-N 3.14Å; G14-N16 PolarHBondContact O-N 2.98Å; N16-Y18 VanDerWaalsContact C-N 3.31Å; N16-Y18 PolarHBondContact O-N 2.96Å; N16-I19 PolarHBondContact O-N 2.86Å; N16-I20 WeakPolarHBondContact O-CB 3.32Å; N16-I20 WeakPolarHBondContact O-CD1 3.47Å; N16-I20 VanDerWaalsContact O-CG1 3.26Å; N16-I20 WeakPolarHBondContact O-CG1 3.28Å; N16-I20 PolarHBondContact O-N 3.49Å
17	I	67.7	Low	61.2	Low	120 Å²	120	115.8 Å²	115.8	62%	0.615	57%	0.573	S	S	*	*	H	α-helix	trans	-63.9	-40	178	-64.6	170.8	0	0	0	110.4	M13 G14 I20 S21	M13-I17 PolarHBondContact O-N 3.03Å; G14-I17 PolarHBondContact O-N 3.29Å; I17-I20 PolarHBondContact O-N 3.3Å; I17-S21 WeakPolarHBondContact O-CB 3.32Å; I17-S21 PolarHBondContact O-N 3.44Å
18	Y	68.1	Low	61.3	Low	172 Å²	172	117.4 Å²	117.4	68%	0.675	58%	0.578	S	S	*	*	H	α-helix	trans	-65.8	-44.8	176.9	-155.8	-91.7	0	0	0	112.1	G14 F15 N16 I20 S21 T22	G14-Y18 PolarHBondContact O-N 3.38Å; F15-Y18 PolarHBondContact O-N 3.13Å; N16-Y18 VanDerWaalsContact C-N 3.31Å; N16-Y18 PolarHBondContact O-N 2.96Å; Y18-I20 PolarHBondContact O-N 3.46Å; Y18-S21 PolarHBondContact O-N 3.21Å; Y18-T22 HydrophobicContact CD1-CG2 4.08Å; Y18-T22 HydrophobicContact CE1-CG2 3.94Å; Y18-T22 WeakPolarHBondContact O-CG2 3.46Å; Y18-T22 PolarHBondContact O-N 3.01Å; Y18-T22 PolarHBondContact O-OG1 3.08Å
19	I	70.5	Confident	61.1	Low	69 Å²	69	115.7 Å²	115.7	35%	0.354	57%	0.571	S	S	.	*	H	α-helix	trans	-58.4	-49.6	175.1	-69	169.7	0	0	0	110.8	F15 N16 S21 T22 F23	F15-I19 HydrophobicContact CD1-CD1 3.72Å; F15-I19 HydrophobicContact CD1-CG1 4.48Å; F15-I19 HydrophobicContact CE1-CD1 3.76Å; F15-I19 HydrophobicContact CE1-CG1 4.48Å; F15-I19 WeakPolarHBondContact O-CG1 3.43Å; F15-I19 PolarHBondContact O-N 3.35Å; F15-I19 VanDerWaalsContact O-N 3.13Å; N16-I19 PolarHBondContact O-N 2.86Å; I19-S21 VanDerWaalsContact C-N 3.32Å; I19-S21 PolarHBondContact O-N 3.45Å; I19-T22 PolarHBondContact O-N 3.15Å; I19-T22 PolarHBondContact O-OG1 3.32Å; I19-F23 HydrophobicContact CG2-CD2 4Å; I19-F23 HydrophobicContact CG2-CE2 4.34Å; I19-F23 PolarHBondContact O-N 3.16Å
20	I	72.2	Confident	61	Low	100 Å²	100	111.9 Å²	111.9	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-59.7	-42.5	178.6	-68.5	164.8	0	0	0	111	N16 I17 Y18 F23 I24	N16-I20 WeakPolarHBondContact O-CB 3.32Å; N16-I20 WeakPolarHBondContact O-CD1 3.47Å; N16-I20 VanDerWaalsContact O-CG1 3.26Å; N16-I20 WeakPolarHBondContact O-CG1 3.28Å; N16-I20 PolarHBondContact O-N 3.49Å; I17-I20 PolarHBondContact O-N 3.3Å; Y18-I20 PolarHBondContact O-N 3.46Å; I20-F23 PolarHBondContact O-N 3.27Å; I20-I24 HydrophobicContact CG2-CD1 3.74Å; I20-I24 HydrophobicContact CG2-CG1 4.43Å; I20-I24 WeakPolarHBondContact O-CG1 3.46Å; I20-I24 PolarHBondContact O-N 3.25Å
21	S	69.5	Low	60.7	Low	71 Å²	71	112.8 Å²	112.8	50%	0.497	58%	0.575	S	S	.	*	H	α-helix	trans	-61.1	-44.8	175.7	-177.3	0	0	0	0	112.1	I17 Y18 I19 F23 I24 C25	I17-S21 WeakPolarHBondContact O-CB 3.32Å; I17-S21 PolarHBondContact O-N 3.44Å; Y18-S21 PolarHBondContact O-N 3.21Å; I19-S21 VanDerWaalsContact C-N 3.32Å; I19-S21 PolarHBondContact O-N 3.45Å; S21-F23 PolarHBondContact O-N 3.04Å; S21-I24 PolarHBondContact O-N 2.84Å; S21-C25 WeakPolarHBondContact O-CB 3.5Å; S21-C25 PolarHBondContact O-N 3.08Å
22	T	67.8	Low	60.3	Low	56 Å²	56	110.2 Å²	110.2	34%	0.344	57%	0.569	S	S	.	*	H	α-helix	trans	-65.9	-35.1	176	57.9	0	0	0	0	113	Y18 I19 N26	Y18-T22 HydrophobicContact CD1-CG2 4.08Å; Y18-T22 HydrophobicContact CE1-CG2 3.94Å; Y18-T22 WeakPolarHBondContact O-CG2 3.46Å; Y18-T22 PolarHBondContact O-N 3.01Å; Y18-T22 PolarHBondContact O-OG1 3.08Å; I19-T22 PolarHBondContact O-N 3.15Å; I19-T22 PolarHBondContact O-OG1 3.32Å; T22-N26 WeakPolarHBondContact O-CB 3.24Å; T22-N26 PolarHBondContact O-N 2.91Å; T22-N26 PolarHBondContact O-ND2 2.93Å
23	F	69.2	Low	59.6	Low	137 Å²	137	107.8 Å²	107.8	60%	0.601	56%	0.564	S	S	*	*	H	α-helix	trans	-66.9	-43.5	174.4	-102.7	-86.7	0	0	0	112.4	I19 I20 S21 N26 L27	I19-F23 HydrophobicContact CG2-CD2 4Å; I19-F23 HydrophobicContact CG2-CE2 4.34Å; I19-F23 PolarHBondContact O-N 3.16Å; I20-F23 PolarHBondContact O-N 3.27Å; S21-F23 PolarHBondContact O-N 3.04Å; F23-N26 PolarHBondContact O-N 2.86Å; F23-L27 PolarHBondContact O-N 3.34Å
24	I	71.2	Confident	58.9	Low	96 Å²	96	109.2 Å²	109.2	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-64.9	-43	176.3	-68.3	168.2	0	0	0	110.6	I20 S21 N26 L27 I28	I20-I24 HydrophobicContact CG2-CD1 3.74Å; I20-I24 HydrophobicContact CG2-CG1 4.43Å; I20-I24 WeakPolarHBondContact O-CG1 3.46Å; I20-I24 PolarHBondContact O-N 3.25Å; S21-I24 PolarHBondContact O-N 2.84Å; I24-N26 PolarHBondContact O-N 2.96Å; I24-L27 PolarHBondContact O-N 3.3Å; I24-I28 HydrophobicContact CG2-CD1 3.83Å; I24-I28 WeakPolarHBondContact O-CG1 3.29Å; I24-I28 PolarHBondContact O-N 3.44Å
25	C	65.5	Low	58.5	Low	73 Å²	73	110.1 Å²	110.1	49%	0.493	58%	0.575	S	S	.	*	H	α-helix	trans	-62.9	-42.6	178.2	-158.8	0	0	0	0	111.7	S21 I28 F29	S21-C25 WeakPolarHBondContact O-CB 3.5Å; S21-C25 PolarHBondContact O-N 3.08Å; C25-I28 PolarHBondContact O-N 3.36Å; C25-F29 PolarHBondContact O-N 3.06Å
26	N	60.8	Low	58.4	Low	105 Å²	105	109 Å²	109	56%	0.561	58%	0.582	S	S	*	*	H	α-helix	trans	-64.6	-40.5	173.6	-77.3	-43.3	0	0	0	112.7	T22 F23 I24 I28 F29 V30	T22-N26 WeakPolarHBondContact O-CB 3.24Å; T22-N26 PolarHBondContact O-N 2.91Å; T22-N26 PolarHBondContact O-ND2 2.93Å; F23-N26 PolarHBondContact O-N 2.86Å; I24-N26 PolarHBondContact O-N 2.96Å; N26-I28 VanDerWaalsContact C-N 3.33Å; N26-I28 PolarHBondContact O-N 3.15Å; N26-F29 PolarHBondContact O-N 2.88Å; N26-V30 WeakPolarHBondContact O-CB 3.35Å; N26-V30 VanDerWaalsContact O-CG2 3.3Å; N26-V30 WeakPolarHBondContact O-CG2 3.43Å; N26-V30 PolarHBondContact O-N 3.06Å
27	L	60	Low	58.2	Low	114 Å²	114	110.8 Å²	110.8	60%	0.597	59%	0.592	S	S	*	*	H	α-helix	trans	-58.5	-44.6	174.8	-112.1	77.3	0	0	0	111.9	F23 I24 V30 Q31	F23-L27 PolarHBondContact O-N 3.34Å; I24-L27 PolarHBondContact O-N 3.3Å; L27-V30 PolarHBondContact O-N 3.07Å; L27-Q31 PolarHBondContact O-N 3.22Å; L27-Q31 VanDerWaalsContact O-N 3.11Å
28	I	56.5	Low	57.8	Low	111 Å²	111	110 Å²	110	57%	0.569	59%	0.589	S	S	*	*	H	α-helix	trans	-66.5	-38.1	179.4	-66.1	166.7	0	0	0	111.2	I24 C25 N26 Q31 S32	I24-I28 HydrophobicContact CG2-CD1 3.83Å; I24-I28 WeakPolarHBondContact O-CG1 3.29Å; I24-I28 PolarHBondContact O-N 3.44Å; C25-I28 PolarHBondContact O-N 3.36Å; N26-I28 VanDerWaalsContact C-N 3.33Å; N26-I28 PolarHBondContact O-N 3.15Å; I28-Q31 PolarHBondContact O-N 3.38Å; I28-S32 PolarHBondContact O-OG 3.49Å; I28-S32 VanDerWaalsContact O-OG 3.11Å
29	F	47.1	Very low	58.2	Low	135 Å²	135	106.5 Å²	106.5	59%	0.592	59%	0.587	S	S	*	*	H	α-helix	trans	-71.7	-31.5	176.6	-115.5	-85.6	0	0	0	113.9	C25 N26 S32 N33	C25-F29 PolarHBondContact O-N 3.06Å; N26-F29 PolarHBondContact O-N 2.88Å; F29-S32 PolarHBondContact O-OG 3.11Å; F29-N33 PolarHBondContact O-ND2 2.89Å
30	V	48.8	Very low	58.4	Low	116 Å²	116	110.1 Å²	110.1	70%	0.703	60%	0.602	S	S	*	*	H	α-helix	trans	-69.5	-37.7	173.7	166.8	0	0	0	0	111	N26 L27 S32	N26-V30 WeakPolarHBondContact O-CB 3.35Å; N26-V30 VanDerWaalsContact O-CG2 3.3Å; N26-V30 WeakPolarHBondContact O-CG2 3.43Å; N26-V30 PolarHBondContact O-N 3.06Å; L27-V30 PolarHBondContact O-N 3.07Å; V30-S32 VanDerWaalsContact C-N 3.25Å; V30-S32 PolarHBondContact O-N 3.44Å
31	Q	44.2	Very low	58.6	Low	172 Å²	172	109 Å²	109	80%	0.804	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-2	-176	-159.3	162.8	2.2	0	0	114.6	L27 I28	L27-Q31 PolarHBondContact O-N 3.22Å; L27-Q31 VanDerWaalsContact O-N 3.11Å; I28-Q31 PolarHBondContact O-N 3.38Å
32	S	45.1	Very low	58.7	Low	76 Å²	76	109.6 Å²	109.6	53%	0.531	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.8	1.8	-179.9	46.9	0	0	0	0	115	I28 F29 V30	I28-S32 PolarHBondContact O-OG 3.49Å; I28-S32 VanDerWaalsContact O-OG 3.11Å; F29-S32 PolarHBondContact O-OG 3.11Å; V30-S32 VanDerWaalsContact C-N 3.25Å; V30-S32 PolarHBondContact O-N 3.44Å
33	N	39.2	Very low	59.2	Low	117 Å²	117	112.9 Å²	112.9	63%	0.626	61%	0.606	S	S	*	*			trans	-128.9	57.7	-177.6	-72.1	-68.2	0	0	0	113.1	F29 A35	F29-N33 PolarHBondContact O-ND2 2.89Å; N33-A35 PolarHBondContact O-N 3.39Å
34	M	40.7	Very low	59.7	Low	166 Å²	166	111.6 Å²	111.6	82%	0.818	60%	0.602	S	S	*	*			trans	-72.3	95.2	160.9	-76	-170.2	175.8	0	0	109.1
35	A	46.3	Very low	60	Low	62 Å²	62	108.2 Å²	108.2	51%	0.512	58%	0.584	S	S	.	*			trans	-67.1	143.9	172.3	0	0	0	0	0	110.1	N33 N37	N33-A35 PolarHBondContact O-N 3.39Å; A35-N37 PolarHBondContact O-N 3.3Å
36	P	54.1	Low	60.6	Low	125 Å²	125	107.9 Å²	107.9	81%	0.812	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	27.1	-170.4	33.3	-38.5	0	0	0	114.4
37	N	56.9	Low	61.4	Low	134 Å²	134	106.6 Å²	106.6	72%	0.717	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	-1.5	-164.6	-71.4	0.7	0	0	0	114.7	A35 P39	A35-N37 PolarHBondContact O-N 3.3Å; N37-P39 VanDerWaalsContact O-CD 3.25Å; N37-P39 WeakPolarHBondContact O-CD 3.3Å
38	D	60.7	Low	62.3	Low	103 Å²	103	106 Å²	106	55%	0.551	56%	0.559	S	S	*	*			trans	-75.6	109.5	176.9	-71.3	-18.3	0	0	0	110.3	E40 L41 L42	D38-E40 VanDerWaalsContact C-N 3.33Å; D38-E40 PolarHBondContact O-N 3.35Å; D38-L41 HydrophobicContact CB-CB 4.2Å; D38-L41 PolarHBondContact O-N 2.86Å; D38-L42 PolarHBondContact O-N 2.87Å
39	P	74.9	Confident	63.3	Low	98 Å²	98	100.8 Å²	100.8	64%	0.636	53%	0.532	S	S	*	.	H	α-helix	trans	-68.4	-32.9	-170.2	27.6	-34.7	0	0	0	112.5	N37 L42 E43	N37-P39 VanDerWaalsContact O-CD 3.25Å; N37-P39 WeakPolarHBondContact O-CD 3.3Å; P39-L42 PolarHBondContact O-N 3.42Å; P39-E43 PolarHBondContact O-N 2.72Å
40	E	76.5	Confident	64.9	Low	145 Å²	145	97.7 Å²	97.7	68%	0.678	52%	0.517	S	S	*	.	H	α-helix	trans	-66.4	-36.9	179.4	-59.2	-174	175.2	0	0	112.2	D38 E43 Q44	D38-E40 VanDerWaalsContact C-N 3.33Å; D38-E40 PolarHBondContact O-N 3.35Å; E40-E43 PolarHBondContact O-N 3.44Å; E40-Q44 VanDerWaalsContact O-CG 3.31Å; E40-Q44 WeakPolarHBondContact O-CG 3.47Å; E40-Q44 PolarHBondContact O-N 3.46Å
41	L	75.9	Confident	66.3	Low	78 Å²	78	101 Å²	101	41%	0.408	52%	0.517	S	S	.	.	H	α-helix	trans	-67.1	-43	175.8	-178.9	64.4	0	0	0	110.5	D38 Q44 L45	D38-L41 HydrophobicContact CB-CB 4.2Å; D38-L41 PolarHBondContact O-N 2.86Å; L41-Q44 PolarHBondContact O-N 3.17Å; L41-L45 HydrophobicContact CG-CD1 4.16Å; L41-L45 WeakPolarHBondContact O-CD1 3.29Å; L41-L45 VanDerWaalsContact O-CG 3.3Å; L41-L45 WeakPolarHBondContact O-CG 3.5Å; L41-L45 PolarHBondContact O-N 3.17Å
42	L	72.2	Confident	67.8	Low	82 Å²	82	97.4 Å²	97.4	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-42.8	176.8	-174.7	60.6	0	0	0	111.4	D38 P39 L45 W46 L112	D38-L42 PolarHBondContact O-N 2.87Å; P39-L42 PolarHBondContact O-N 3.42Å; L42-L45 PolarHBondContact O-N 3.34Å; L42-W46 PolarHBondContact O-N 3.07Å; L42-L112 HydrophobicContact CD1-CD1 3.74Å
43	E	78.4	Confident	69.4	Low	126 Å²	126	94.5 Å²	94.5	59%	0.589	48%	0.475	S	S	*	.	H	α-helix	trans	-62.4	-43.2	175.2	-171.2	179.4	172.7	0	0	112.2	P39 E40 L45 W46 I47	P39-E43 PolarHBondContact O-N 2.72Å; E40-E43 PolarHBondContact O-N 3.44Å; E43-L45 PolarHBondContact O-N 3.13Å; E43-W46 WeakPolarHBondContact O-CB 3.35Å; E43-W46 PolarHBondContact O-N 3.43Å; E43-I47 HydrophobicContact CG-CD1 3.97Å; E43-I47 WeakPolarHBondContact O-CG1 3.49Å; E43-I47 PolarHBondContact O-N 3.04Å
44	Q	79.7	Confident	71	Confident	110 Å²	110	91 Å²	91	51%	0.514	46%	0.458	S	S	.	.	H	α-helix	trans	-61.9	-41.3	176.3	-73.2	177.4	34.8	0	0	112.4	E40 L41 I47 Q48	E40-Q44 VanDerWaalsContact O-CG 3.31Å; E40-Q44 WeakPolarHBondContact O-CG 3.47Å; E40-Q44 PolarHBondContact O-N 3.46Å; L41-Q44 PolarHBondContact O-N 3.17Å; Q44-I47 PolarHBondContact O-N 3.23Å; Q44-Q48 WeakPolarHBondContact O-CG 3.41Å; Q44-Q48 PolarHBondContact O-N 3.43Å
45	L	76.6	Confident	72.6	Confident	24 Å²	24	84.6 Å²	84.6	13%	0.126	44%	0.435	C	S	.	.	H	α-helix	trans	-64.2	-40.4	175.3	-70.7	163.1	0	0	0	111.8	L41 L42 E43 Q48 L49 L112 M115	L41-L45 HydrophobicContact CG-CD1 4.16Å; L41-L45 WeakPolarHBondContact O-CD1 3.29Å; L41-L45 VanDerWaalsContact O-CG 3.3Å; L41-L45 WeakPolarHBondContact O-CG 3.5Å; L41-L45 PolarHBondContact O-N 3.17Å; L42-L45 PolarHBondContact O-N 3.34Å; E43-L45 PolarHBondContact O-N 3.13Å; L45-Q48 PolarHBondContact O-N 2.98Å; L45-L49 PolarHBondContact O-N 2.74Å; L45-L112 HydrophobicContact CB-CB 4.46Å; L45-L112 HydrophobicContact CB-CD1 4.25Å; L45-L112 HydrophobicContact CB-CD2 4.3Å; L45-L112 HydrophobicContact CD1-CD1 4.38Å; L45-M115 HydrophobicContact CD1-CE 3.58Å; L45-M115 HydrophobicContact CD2-CE 4.38Å
46	W	77.7	Confident	73.8	Confident	67 Å²	67	85.4 Å²	85.4	25%	0.254	44%	0.436	S	S	.	.	H	α-helix	trans	-60.3	-47.2	172.5	-86.3	117.1	0	0	0	112.6	L42 E43 Q48 L49 Y50 L112 V120 R121 L122	L42-W46 PolarHBondContact O-N 3.07Å; E43-W46 WeakPolarHBondContact O-CB 3.35Å; E43-W46 PolarHBondContact O-N 3.43Å; W46-Q48 VanDerWaalsContact C-N 3.25Å; W46-Q48 PolarHBondContact O-N 3.2Å; W46-L49 HydrophobicContact CZ3-CD2 4.37Å; W46-L49 PolarHBondContact O-N 2.78Å; W46-Y50 HydrophobicContact CD2-CE2 4.37Å; W46-Y50 AromaticContact CE3-CD2 3.91Å; W46-Y50 HydrophobicContact CE3-CD2 3.91Å; W46-Y50 AromaticContact CE3-CE2 3.39Å; W46-Y50 HydrophobicContact CE3-CE2 3.39Å; W46-Y50 AromaticContact CZ3-CE2 3.7Å; W46-Y50 HydrophobicContact CZ3-CE2 3.7Å; W46-Y50 WeakPolarHBondContact O-CD2 3.39Å; W46-Y50 PolarHBondContact O-N 2.85Å; W46-L112 HydrophobicContact CD2-CD2 4.16Å; W46-L112 HydrophobicContact CE3-CD2 4.38Å; W46-L112 HydrophobicContact CG-CD2 4.47Å; W46-V120 HydrophobicContact CH2-CG1 3.23Å; W46-V120 HydrophobicContact CZ2-CG1 3.83Å; W46-V120 HydrophobicContact CZ3-CG1 3.84Å; W46-R121 VanDerWaalsContact CH2-O 3.3Å; W46-R121 WeakPolarHBondContact CH2-O 3.41Å; W46-L122 HydrophobicContact CH2-CD2 4.41Å; W46-L122 HydrophobicContact CZ3-CD2 3.96Å
47	I	79.1	Confident	74.3	Confident	77 Å²	77	84.2 Å²	84.2	40%	0.395	43%	0.43	S	S	.	.	H	α-helix	trans	-62.8	-33.5	178.4	-68.8	165.7	0	0	0	111.3	E43 Q44 R51	E43-I47 HydrophobicContact CG-CD1 3.97Å; E43-I47 WeakPolarHBondContact O-CG1 3.49Å; E43-I47 PolarHBondContact O-N 3.04Å; Q44-I47 PolarHBondContact O-N 3.23Å; I47-R51 WeakPolarHBondContact O-CG 3.47Å
48	Q	78.4	Confident	74.7	Confident	101 Å²	101	82.5 Å²	82.5	47%	0.472	42%	0.419	S	S	.	.	H	α-helix	trans	-68.2	-50	172.7	-71.5	177	14.6	0	0	111.6	Q44 L45 W46 Y50 R51 Y52	Q44-Q48 WeakPolarHBondContact O-CG 3.41Å; Q44-Q48 PolarHBondContact O-N 3.43Å; L45-Q48 PolarHBondContact O-N 2.98Å; W46-Q48 VanDerWaalsContact C-N 3.25Å; W46-Q48 PolarHBondContact O-N 3.2Å; Q48-Y50 PolarHBondContact O-N 3.28Å; Q48-R51 WeakPolarHBondContact O-CB 3.32Å; Q48-R51 PolarHBondContact O-N 2.74Å; Q48-R51 VanDerWaalsContact O-N 3.1Å; Q48-Y52 VanDerWaalsContact O-CD2 3.23Å; Q48-Y52 WeakPolarHBondContact O-CD2 3.49Å
49	L	77.8	Confident	74.8	Confident	2 Å²	2	78.7 Å²	78.7	1%	0.01	40%	0.404	C	S	.	.	H	α-helix	trans	-60	-44.1	-179.1	-175.1	62.6	0	0	0	112.2	L45 W46 R51 Y52 L53 V107 L112 V120 L122	L45-L49 PolarHBondContact O-N 2.74Å; W46-L49 HydrophobicContact CZ3-CD2 4.37Å; W46-L49 PolarHBondContact O-N 2.78Å; L49-R51 PolarHBondContact O-N 3.11Å; L49-R51 VanDerWaalsContact O-N 3.14Å; L49-Y52 PolarHBondContact O-N 3.15Å; L49-L53 HydrophobicContact CD2-CD1 4.45Å; L49-L53 HydrophobicContact CG-CD1 3.93Å; L49-L53 HydrophobicContact CG-CG 4.31Å; L49-L53 WeakPolarHBondContact O-CG 3.35Å; L49-L53 PolarHBondContact O-N 3.18Å; L49-L53 VanDerWaalsContact O-N 3.09Å; L49-V107 HydrophobicContact CD1-CG1 4.23Å; L49-L112 HydrophobicContact CD2-CD2 4.04Å; L49-V120 HydrophobicContact CD2-CG1 4.47Å; L49-L122 HydrophobicContact CD2-CD2 4.27Å
50	Y	80.4	Confident	74.1	Confident	70 Å²	70	75.9 Å²	75.9	28%	0.275	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.7	177.4	-84.1	-66.1	0	0	0	114.9	W46 Q48 L53 D123 K126 V127	W46-Y50 HydrophobicContact CD2-CE2 4.37Å; W46-Y50 AromaticContact CE3-CD2 3.91Å; W46-Y50 HydrophobicContact CE3-CD2 3.91Å; W46-Y50 AromaticContact CE3-CE2 3.39Å; W46-Y50 HydrophobicContact CE3-CE2 3.39Å; W46-Y50 AromaticContact CZ3-CE2 3.7Å; W46-Y50 HydrophobicContact CZ3-CE2 3.7Å; W46-Y50 WeakPolarHBondContact O-CD2 3.39Å; W46-Y50 PolarHBondContact O-N 2.85Å; Q48-Y50 PolarHBondContact O-N 3.28Å; Y50-L53 HydrophobicContact CD1-CD1 3.81Å; Y50-L53 HydrophobicContact CE1-CD1 4.01Å; Y50-L53 HydrophobicContact CG-CD1 4.37Å; Y50-D123 VanDerWaalsContact OH-CB 3.25Å; Y50-D123 WeakPolarHBondContact OH-CB 3.47Å; Y50-D123 PolarHBondContact OH-N 3.09Å; Y50-K126 HydrophobicContact CD1-CB 4.18Å; Y50-K126 HydrophobicContact CD1-CD 4.24Å; Y50-K126 HydrophobicContact CE1-CB 3.74Å; Y50-K126 HydrophobicContact CE1-CD 3.9Å; Y50-K126 HydrophobicContact CE1-CG 4.46Å; Y50-V127 HydrophobicContact CE1-CG2 4.02Å
51	R	77.5	Confident	73	Confident	186 Å²	186	77.1 Å²	77.1	70%	0.702	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-16.6	171.8	-69.9	169.3	-176.4	-172.5	2.5	113.7	I47 Q48 L49	I47-R51 WeakPolarHBondContact O-CG 3.47Å; Q48-R51 WeakPolarHBondContact O-CB 3.32Å; Q48-R51 PolarHBondContact O-N 2.74Å; Q48-R51 VanDerWaalsContact O-N 3.1Å; L49-R51 PolarHBondContact O-N 3.11Å; L49-R51 VanDerWaalsContact O-N 3.14Å
52	Y	76.2	Confident	72	Confident	97 Å²	97	75.8 Å²	75.8	38%	0.38	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-20	-179.7	-57.1	-55.6	0	0	0	113.2	Q48 L49 R106	Q48-Y52 VanDerWaalsContact O-CD2 3.23Å; Q48-Y52 WeakPolarHBondContact O-CD2 3.49Å; L49-Y52 PolarHBondContact O-N 3.15Å; Y52-R106 HydrophobicContact CD1-CB 4.39Å; Y52-R106 HydrophobicContact CG-CB 4.21Å
53	L	77.9	Confident	70.7	Confident	15 Å²	15	75.9 Å²	75.9	8%	0.079	39%	0.389	C	S	.	.	S	Bend	trans	-62.8	141.5	171.4	-75	164.6	0	0	0	111.6	L49 Y50 G55 L122 V127 Y210	L49-L53 HydrophobicContact CD2-CD1 4.45Å; L49-L53 HydrophobicContact CG-CD1 3.93Å; L49-L53 HydrophobicContact CG-CG 4.31Å; L49-L53 WeakPolarHBondContact O-CG 3.35Å; L49-L53 PolarHBondContact O-N 3.18Å; L49-L53 VanDerWaalsContact O-N 3.09Å; Y50-L53 HydrophobicContact CD1-CD1 3.81Å; Y50-L53 HydrophobicContact CE1-CD1 4.01Å; Y50-L53 HydrophobicContact CG-CD1 4.37Å; L53-G55 PolarHBondContact O-N 3.37Å; L53-L122 HydrophobicContact CD1-CD1 4.37Å; L53-L122 HydrophobicContact CD1-CD2 3.89Å; L53-L122 HydrophobicContact CD2-CD1 3.94Å; L53-V127 HydrophobicContact CB-CG1 4.49Å; L53-V127 HydrophobicContact CB-CG2 4.24Å; L53-V127 HydrophobicContact CD1-CG2 3.89Å; L53-V127 HydrophobicContact CD2-CG1 4.07Å; L53-V127 HydrophobicContact CD2-CG2 4.41Å; L53-V127 HydrophobicContact CG-CG2 4.41Å; L53-Y210 HydrophobicContact CD2-CE1 3.83Å; L53-Y210 WeakPolarHBondContact CD2-OH 3.35Å
54	P	74.2	Confident	69.3	Low	42 Å²	42	74.7 Å²	74.7	27%	0.273	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-69	121.5	176	28	-33.1	0	0	0	110.1	V127 W128	P54-V127 HydrophobicContact CG-CG1 4.45Å; P54-V127 CarbonylContact O-C 3.54Å; P54-V127 WeakPolarHBondContact O-CA 3.46Å; P54-W128 HydrophobicContact CB-CB 4.07Å; P54-W128 HydrophobicContact CG-CB 4.09Å; P54-W128 PolarHBondContact O-N 3.05Å
55	G	72.6	Confident	67.8	Low	32 Å²	32	76.6 Å²	76.6	33%	0.33	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-64.8	157.1	174.9	0	0	0	0	0	112.4	L53 S57 M58	L53-G55 PolarHBondContact O-N 3.37Å; G55-S57 PolarHBondContact O-N 3.45Å; G55-M58 PolarHBondContact O-N 3.33Å
56	P	72.2	Confident	66.5	Low	80 Å²	80	81.3 Å²	81.3	52%	0.519	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.5	-164.5	23.7	-36.3	0	0	0	115.1
57	S	65.1	Low	65.5	Low	99 Å²	99	79.5 Å²	79.5	69%	0.692	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-5	176.6	57.5	0	0	0	0	114.8	G55	G55-S57 PolarHBondContact O-N 3.45Å
58	M	64.2	Low	64.6	Low	99 Å²	99	76.2 Å²	76.2	49%	0.488	42%	0.415	S	S	.	.			trans	-120.2	88.5	-175.7	-65.8	-121.7	-164.9	0	0	111.4	G55 K61	G55-M58 PolarHBondContact O-N 3.33Å; M58-K61 PolarHBondContact SD-NZ 3.48Å
59	G	63.5	Low	64.2	Low	22 Å²	22	74.5 Å²	74.5	23%	0.227	41%	0.409	C	S	.	.			trans	-59.2	158.8	166.4	0	0	0	0	0	112.5	K61	G59-K61 PolarHBondContact O-N 3.2Å
60	P	59.2	Low	64.1	Low	39 Å²	39	74.5 Å²	74.5	25%	0.253	41%	0.409	S	S	.	.			trans	-58.4	113.8	-173.9	22.4	-33.6	0	0	0	111.4	L62 W128	P60-L62 HydrophobicContact CB-CD1 4.5Å; P60-L62 PolarHBondContact O-N 3.46Å; P60-W128 HydrophobicContact CG-CE3 4.44Å; P60-W128 HydrophobicContact CG-CH2 4.34Å; P60-W128 HydrophobicContact CG-CZ3 4.09Å
61	K	54.1	Low	64.1	Low	171 Å²	171	74.6 Å²	74.6	74%	0.743	41%	0.412	S	S	*	.			trans	-77.1	65	-179.6	-69.9	180	178.4	171.5	0	111.6	M58 G59	M58-K61 PolarHBondContact SD-NZ 3.48Å; G59-K61 PolarHBondContact O-N 3.2Å
62	L	54.5	Low	64.2	Low	51 Å²	51	65.9 Å²	65.9	27%	0.267	38%	0.379	S	S	.	.			trans	-86.5	140.4	172.7	-93.3	37.5	0	0	0	110.4	P60 L66 A68 T103	P60-L62 HydrophobicContact CB-CD1 4.5Å; P60-L62 PolarHBondContact O-N 3.46Å; L62-L66 WeakPolarHBondContact CD2-O 3.33Å; L62-A68 HydrophobicContact CD2-CB 3.79Å; L62-T103 HydrophobicContact CD1-CG2 4.18Å; L62-T103 HydrophobicContact CD2-CG2 3.86Å
63	S	46	Very low	64.4	Low	84 Å²	84	62.1 Å²	62.1	59%	0.587	37%	0.367	S	S	*	.			trans	-59.2	149.9	164.4	43.9	0	0	0	0	110.5	D65 L66	S63-D65 PolarHBondContact O-N 3.07Å; S63-L66 PolarHBondContact O-N 3.44Å
64	S	49	Very low	64.7	Low	100 Å²	100	61.5 Å²	61.5	70%	0.699	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-42	-43.2	-173.7	41.4	0	0	0	0	114.4	L66	S64-L66 VanDerWaalsContact C-N 3.25Å; S64-L66 PolarHBondContact O-N 3.26Å
65	D	46.6	Very low	65.2	Low	150 Å²	150	59.8 Å²	59.8	80%	0.802	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-80.6	-8.6	-166.8	-44.5	-11.5	0	0	0	112.5	S63	S63-D65 PolarHBondContact O-N 3.07Å
66	L	50.9	Low	65.8	Low	123 Å²	123	58.2 Å²	58.2	64%	0.644	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-120.8	20.5	-176.4	-149	76.5	0	0	0	112.8	L62 S63 S64 A68	L62-L66 WeakPolarHBondContact CD2-O 3.33Å; S63-L66 PolarHBondContact O-N 3.44Å; S64-L66 VanDerWaalsContact C-N 3.25Å; S64-L66 PolarHBondContact O-N 3.26Å; L66-A68 PolarHBondContact O-N 3.48Å
67	S	55.4	Low	66.3	Low	29 Å²	29	57.4 Å²	57.4	20%	0.203	33%	0.329	C	S	.	.			trans	-49.7	123.2	-174.3	67.3	0	0	0	0	112.1	N69	S67-N69 PolarHBondContact O-N 2.04Å; S67-N69 VanDerWaalsContact O-N 3.09Å
68	A	61.7	Low	67.3	Low	8 Å²	8	54.6 Å²	54.6	7%	0.066	31%	0.305	C	S	.	.			trans	-58.6	118.3	-176.3	0	0	0	0	0	110.2	L62 L66 I70 P250	L62-A68 HydrophobicContact CD2-CB 3.79Å; L66-A68 PolarHBondContact O-N 3.48Å; A68-I70 PolarHBondContact O-N 2.98Å; A68-P250 WeakPolarHBondContact O-CB 3.43Å
69	N	69.6	Low	68.1	Low	65 Å²	65	49.9 Å²	49.9	35%	0.348	28%	0.283	S	S	.	.			trans	-75.9	110.5	177.7	-59.1	-56.3	0	0	0	108	S67 K253	S67-N69 PolarHBondContact O-N 2.04Å; S67-N69 VanDerWaalsContact O-N 3.09Å; N69-K253 HydrophobicContact CB-CD 3.99Å; N69-K253 HydrophobicContact CB-CG 4.35Å; N69-K253 VanDerWaalsContact OD1-CD 3.28Å; N69-K253 WeakPolarHBondContact OD1-CD 3.21Å; N69-K253 WeakPolarHBondContact OD1-CE 3.14Å; N69-K253 PolarHBondContact OD1-NZ 2.86Å
70	I	76.1	Confident	69.1	Low	2 Å²	2	51.9 Å²	51.9	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	112.3	174.7	-55	179.2	0	0	0	107.6	A68 L72 A98 W100 W128 P130 P250 I251 I252 K253	A68-I70 PolarHBondContact O-N 2.98Å; I70-L72 PolarHBondContact O-N 2.75Å; I70-A98 HydrophobicContact CG2-CB 3.92Å; I70-W100 HydrophobicContact CG1-CB 4.14Å; I70-W100 HydrophobicContact CG2-CE3 4.36Å; I70-W128 HydrophobicContact CD1-CH2 4.17Å; I70-P130 HydrophobicContact CD1-CB 4.05Å; I70-P130 HydrophobicContact CD1-CG 4.28Å; I70-P250 HydrophobicContact CD1-CB 4.07Å; I70-P250 HydrophobicContact CD1-CG 3.72Å; I70-P250 HydrophobicContact CG1-CB 4.39Å; I70-I251 PolarHBondContact N-O 2.9Å; I70-I252 HydrophobicContact CB-CG1 4.37Å; I70-K253 PolarHBondContact O-N 3.4Å; I70-K253 VanDerWaalsContact O-O 3.1Å
71	E	79.7	Confident	69.9	Low	72 Å²	72	52 Å²	52	34%	0.336	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	106.8	170.9	-61.6	-153.6	158.7	0	0	108.9	A98 E99 K253 T255 K258	E71-A98 CarbonylContact O-C 3.53Å; E71-A98 WeakPolarHBondContact O-CA 3.22Å; E71-E99 HydrophobicContact CB-CB 4.38Å; E71-E99 PolarHBondContact N-O 3.43Å; E71-E99 PolarHBondContact O-N 3.22Å; E71-K253 WeakPolarHBondContact CA-O 3.48Å; E71-T255 HydrophobicContact CB-CG2 3.87Å; E71-T255 HydrophobicContact CG-CG2 3.61Å; E71-T255 WeakPolarHBondContact OE1-CG2 2.99Å; E71-K258 IonicContact OE2-NZ 3.41Å; E71-K258 PolarHBondContact OE2-NZ 2.97Å
72	L	79.6	Confident	71.1	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.1	179.3	-174.5	54.8	0	0	0	111	I70 F97 A98 L132 I252 W254 C259	I70-L72 PolarHBondContact O-N 2.75Å; L72-F97 WeakPolarHBondContact CD1-O 3.44Å; L72-A98 HydrophobicContact CD1-CB 3.97Å; L72-L132 HydrophobicContact CD1-CD1 3.89Å; L72-L132 HydrophobicContact CD2-CD1 3.78Å; L72-L132 HydrophobicContact CD2-CD2 4.04Å; L72-I252 HydrophobicContact CB-CG2 3.72Å; L72-I252 HydrophobicContact CD2-CD1 4.35Å; L72-I252 HydrophobicContact CD2-CG2 3.97Å; L72-W254 HydrophobicContact CB-CH2 4.06Å; L72-W254 HydrophobicContact CB-CZ2 3.96Å; L72-W254 HydrophobicContact CB-CZ3 4.48Å; L72-W254 HydrophobicContact CD2-CH2 3.75Å; L72-W254 HydrophobicContact CD2-CZ2 3.33Å; L72-W254 HydrophobicContact CG-CH2 3.46Å; L72-W254 VanDerWaalsContact CG-CH2 3.46Å; L72-W254 HydrophobicContact CG-CZ2 3.52Å; L72-W254 HydrophobicContact CG-CZ3 4.23Å; L72-W254 VanDerWaalsContact O-CE3 3.22Å; L72-W254 VanDerWaalsContact O-CZ3 3.29Å; L72-W254 WeakPolarHBondContact O-CZ3 3.23Å; L72-C259 PolarHBondContact O-SG 2.9Å
73	S	81.1	Confident	71.9	Confident	18 Å²	18	47.2 Å²	47.2	13%	0.126	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	161.4	178.3	57.4	0	0	0	0	111.1	F97	S73-F97 PolarHBondContact N-O 3.02Å; S73-F97 PolarHBondContact O-N 3.03Å; S73-F97 PolarHBondContact OG-O 3.17Å
74	V	82.8	Confident	73.2	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.8	-172.3	-177.5	0	0	0	0	110.4	L94 T95 L96 I240 W254 C259 C260 L261 I294	V74-L94 HydrophobicContact CG1-CB 4.45Å; V74-L94 HydrophobicContact CG1-CD2 4.36Å; V74-T95 CarbonylContact C-O 3.57Å; V74-T95 WeakPolarHBondContact CA-O 3.48Å; V74-L96 HydrophobicContact CB-CD2 4.32Å; V74-L96 HydrophobicContact CG1-CD2 3.92Å; V74-L96 HydrophobicContact CG2-CD2 3.63Å; V74-I240 HydrophobicContact CG2-CD1 4.32Å; V74-W254 HydrophobicContact CG2-CH2 3.86Å; V74-W254 HydrophobicContact CG2-CZ3 4.08Å; V74-C259 PolarHBondContact N-O 3.25Å; V74-C260 VanDerWaalsContact O-CA 3.29Å; V74-C260 WeakPolarHBondContact O-CA 3.05Å; V74-L261 PolarHBondContact O-N 3.16Å; V74-I294 HydrophobicContact CB-CD1 4.23Å; V74-I294 HydrophobicContact CG1-CD1 3.92Å; V74-I294 HydrophobicContact CG2-CD1 4.14Å
75	S	84.7	Confident	74.1	Confident	6 Å²	6	50.1 Å²	50.1	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.6	158.4	68.3	0	0	0	0	111.3	D77 L94 T95 L261	S75-D77 VanDerWaalsContact CB-OD1 3.29Å; S75-D77 WeakPolarHBondContact CB-OD1 3.39Å; S75-D77 PolarHBondContact OG-OD1 2.74Å; S75-L94 WeakPolarHBondContact O-CA 3.19Å; S75-T95 PolarHBondContact N-O 2.96Å; S75-T95 PolarHBondContact O-N 3.45Å; S75-T95 WeakPolarHBondContact OG-CB 3.34Å; S75-L261 CarbonylContact C-O 3.57Å; S75-L261 WeakPolarHBondContact CA-O 3.47Å
76	V	84.9	Confident	75.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	105.6	171.1	-173.6	0	0	0	0	107.7	L79 L94 L261 L262 S263 V266 L273	V76-L79 HydrophobicContact CG1-CD1 4.22Å; V76-L79 HydrophobicContact CG1-CD2 3.63Å; V76-L79 HydrophobicContact CG1-CG 3.71Å; V76-L94 HydrophobicContact CB-CD2 4.26Å; V76-L94 HydrophobicContact CG1-CD2 4.12Å; V76-L94 HydrophobicContact CG2-CD2 3.73Å; V76-L261 PolarHBondContact N-O 3.48Å; V76-L262 HydrophobicContact CB-CD1 3.92Å; V76-L262 HydrophobicContact CG1-CD1 4.34Å; V76-S263 PolarHBondContact O-N 2.76Å; V76-V266 HydrophobicContact CG1-CG1 4.16Å; V76-L273 HydrophobicContact CB-CD2 4.25Å; V76-L273 HydrophobicContact CG2-CD2 3.74Å
77	D	84	Confident	76.1	Confident	63 Å²	63	49.2 Å²	49.2	34%	0.337	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-35.4	-164.3	-51.9	-36.8	0	0	0	111.1	S75 S93 T95 S263	S75-D77 VanDerWaalsContact CB-OD1 3.29Å; S75-D77 WeakPolarHBondContact CB-OD1 3.39Å; S75-D77 PolarHBondContact OG-OD1 2.74Å; D77-S93 PolarHBondContact N-O 2.86Å; D77-T95 WeakPolarHBondContact OD2-CB 3.28Å; D77-T95 PolarHBondContact OD2-N 3.12Å; D77-T95 PolarHBondContact OD2-OG1 3.08Å; D77-S263 WeakPolarHBondContact O-CB 3.37Å
78	N	84.9	Confident	77.1	Confident	39 Å²	39	48.2 Å²	48.2	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	147.6	172.7	-176.3	27.2	0	0	0	110.6	E80 S93 K269	N78-E80 PolarHBondContact ND2-OE1 2.9Å; N78-S93 PolarHBondContact O-N 3.24Å; N78-K269 PolarHBondContact OD1-NZ 2.9Å
79	L	82.6	Confident	78.2	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.6	170.5	-69.3	-176.3	0	0	0	110.7	V76 A92 V266 K269 I296 F298	V76-L79 HydrophobicContact CG1-CD1 4.22Å; V76-L79 HydrophobicContact CG1-CD2 3.63Å; V76-L79 HydrophobicContact CG1-CG 3.71Å; L79-A92 HydrophobicContact CD2-CB 3.47Å; L79-A92 VanDerWaalsContact CD2-CB 3.47Å; L79-V266 HydrophobicContact CB-CG1 4.05Å; L79-V266 HydrophobicContact CD1-CG1 3.44Å; L79-V266 VanDerWaalsContact CD1-CG1 3.44Å; L79-V266 HydrophobicContact CG-CG1 3.52Å; L79-K269 WeakPolarHBondContact O-CD 3.37Å; L79-K269 PolarHBondContact O-NZ 3.23Å; L79-I296 HydrophobicContact CD1-CG2 3.58Å; L79-I296 HydrophobicContact CD2-CD1 3.8Å; L79-I296 HydrophobicContact CD2-CG1 4.49Å; L79-I296 HydrophobicContact CD2-CG2 4.44Å; L79-F298 HydrophobicContact CB-CZ 4.43Å; L79-F298 HydrophobicContact CD1-CE1 4.44Å; L79-F298 HydrophobicContact CD1-CZ 4.27Å
80	E	82.9	Confident	79	Confident	63 Å²	63	45.2 Å²	45.2	29%	0.294	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	131.8	175.1	-77.9	158.6	-164.3	0	0	109.7	N78 L82 R91	N78-E80 PolarHBondContact ND2-OE1 2.9Å; E80-L82 HydrophobicContact CB-CD1 3.83Å; E80-R91 HydrophobicContact CB-CB 4.25Å; E80-R91 PolarHBondContact N-O 3.2Å; E80-R91 PolarHBondContact O-N 3.49Å; E80-R91 IonicContact OE2-CZ 3.94Å; E80-R91 IonicContact OE2-NH1 2.76Å; E80-R91 PolarHBondContact OE2-NH1 3.11Å
81	L	77.5	Confident	79.6	Confident	42 Å²	42	49.1 Å²	49.1	22%	0.22	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	110.2	174.5	-174.4	70	0	0	0	108.7	L88 I234 F298	L81-L88 HydrophobicContact CD1-CD2 4.32Å; L81-L88 HydrophobicContact CD2-CD2 4.25Å; L81-L88 HydrophobicContact CG-CD2 4.22Å; L81-I234 HydrophobicContact CD2-CD1 3.78Å; L81-F298 HydrophobicContact CD1-CD2 4.42Å; L81-F298 HydrophobicContact CD1-CE2 4.18Å
82	L	79.1	Confident	80	Confident	80 Å²	80	45.7 Å²	45.7	42%	0.419	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	168.9	178.5	-61.7	100.4	0	0	0	110.7	E80 V89 R91	E80-L82 HydrophobicContact CB-CD1 3.83Å; L82-V89 PolarHBondContact N-O 2.84Å; L82-V89 PolarHBondContact O-N 3.04Å; L82-R91 HydrophobicContact CD1-CB 3.4Å; L82-R91 VanDerWaalsContact CD1-CB 3.4Å; L82-R91 HydrophobicContact CD1-CG 4.31Å
83	Y	71.7	Confident	80.5	Confident	42 Å²	42	46.9 Å²	46.9	17%	0.165	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121	172.8	-162.6	-121.2	0	0	0	109.1	N86 Q87 L88 N356 S358	Y83-N86 VanDerWaalsContact CZ-CA 3.43Å; Y83-N86 VanDerWaalsContact OH-CA 3.23Å; Y83-N86 WeakPolarHBondContact OH-CA 3.39Å; Y83-N86 PolarHBondContact OH-O 3.42Å; Y83-Q87 WeakPolarHBondContact CA-O 3.32Å; Y83-Q87 WeakPolarHBondContact CD2-O 3.32Å; Y83-L88 HydrophobicContact CD2-CB 4.5Å; Y83-L88 HydrophobicContact CD2-CD2 3.9Å; Y83-L88 HydrophobicContact CD2-CG 3.95Å; Y83-L88 HydrophobicContact CE2-CD2 4.49Å; Y83-L88 HydrophobicContact CE2-CG 4.13Å; Y83-N356 WeakPolarHBondContact CB-O 3.46Å; Y83-N356 HydrophobicContact CD1-CB 4.32Å; Y83-N356 WeakPolarHBondContact CD1-O 3.46Å; Y83-N356 WeakPolarHBondContact CD2-O 3.38Å; Y83-N356 HydrophobicContact CG-CB 4.19Å; Y83-S358 WeakPolarHBondContact OH-CB 3.33Å; Y83-S358 PolarHBondContact OH-OG 3.21Å
84	H	71.8	Confident	80.8	Confident	81 Å²	81	46.1 Å²	46.1	38%	0.375	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	125.7	-177.9	-168.7	61.9	0	0	0	109.3	N86 Q87 V89 F138	H84-N86 VanDerWaalsContact C-N 3.33Å; H84-N86 PolarHBondContact O-N 2.91Å; H84-Q87 PolarHBondContact N-O 2.84Å; H84-Q87 PolarHBondContact O-N 3.37Å; H84-V89 HydrophobicContact CB-CG2 4.13Å; H84-F138 AromaticContact CD2-CE1 3.61Å; H84-F138 AromaticContact CD2-CZ 3.68Å; H84-F138 AromaticContact NE2-CE1 3.65Å; H84-F138 AromaticContact NE2-CZ 3.68Å
85	K	67.3	Low	81.1	Confident	163 Å²	163	46.4 Å²	46.4	71%	0.709	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	51.3	174.6	-60	173.7	-177.7	172.8	0	113.5	Q87	K85-Q87 VanDerWaalsContact C-N 3.28Å; K85-Q87 PolarHBondContact O-N 3.49Å
86	N	68	Low	81.2	Confident	133 Å²	133	46.2 Å²	46.2	71%	0.711	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	16.5	-178.1	-63.8	-8.7	0	0	0	116.5	Y83 H84	Y83-N86 VanDerWaalsContact CZ-CA 3.43Å; Y83-N86 VanDerWaalsContact OH-CA 3.23Å; Y83-N86 WeakPolarHBondContact OH-CA 3.39Å; Y83-N86 PolarHBondContact OH-O 3.42Å; H84-N86 VanDerWaalsContact C-N 3.33Å; H84-N86 PolarHBondContact O-N 2.91Å
87	Q	73.2	Confident	81.3	Confident	121 Å²	121	49 Å²	49	57%	0.565	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.9	174.7	-61.4	-174.9	-3.3	0	0	111.9	Y83 H84 K85	Y83-Q87 WeakPolarHBondContact CA-O 3.32Å; Y83-Q87 WeakPolarHBondContact CD2-O 3.32Å; H84-Q87 PolarHBondContact N-O 2.84Å; H84-Q87 PolarHBondContact O-N 3.37Å; K85-Q87 VanDerWaalsContact C-N 3.28Å; K85-Q87 PolarHBondContact O-N 3.49Å
88	L	76.4	Confident	81.4	Confident	9 Å²	9	46.1 Å²	46.1	5%	0.047	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.1	169.9	-77	165.3	0	0	0	109.2	L81 Y83 C222 E224 I234	L81-L88 HydrophobicContact CD1-CD2 4.32Å; L81-L88 HydrophobicContact CD2-CD2 4.25Å; L81-L88 HydrophobicContact CG-CD2 4.22Å; Y83-L88 HydrophobicContact CD2-CB 4.5Å; Y83-L88 HydrophobicContact CD2-CD2 3.9Å; Y83-L88 HydrophobicContact CD2-CG 3.95Å; Y83-L88 HydrophobicContact CE2-CD2 4.49Å; Y83-L88 HydrophobicContact CE2-CG 4.13Å; L88-C222 HydrophobicContact CB-CB 3.98Å; L88-C222 PolarHBondContact O-N 3.49Å; L88-E224 HydrophobicContact CD1-CG 3.93Å; L88-I234 HydrophobicContact CD1-CD1 4.21Å; L88-I234 HydrophobicContact CD1-CG2 4.43Å
89	V	84.7	Confident	81.4	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.055	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.5	-177.7	179.4	0	0	0	0	108.4	L82 H84 E219 V220	L82-V89 PolarHBondContact N-O 2.84Å; L82-V89 PolarHBondContact O-N 3.04Å; H84-V89 HydrophobicContact CB-CG2 4.13Å; V89-E219 HydrophobicContact CG1-CB 3.75Å; V89-E219 HydrophobicContact CG1-CG 4.49Å; V89-V220 WeakPolarHBondContact CA-O 3.31Å
90	C	85.6	Confident	81.5	Confident	1 Å²	1	47 Å²	47	1%	0.007	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.5	170.4	-174.2	0	0	0	0	108.9	E219 V220 C222 C236 F298	C90-E219 CarbonylContact O-C 3.51Å; C90-E219 WeakPolarHBondContact O-CA 3.34Å; C90-V220 PolarHBondContact N-O 3.38Å; C90-V220 PolarHBondContact O-N 3.29Å; C90-C222 PolarHBondContact N-SG 2.93Å; C90-C236 HydrophobicContact CB-CB 3.59Å; C90-F298 HydrophobicContact CB-CE2 4.39Å
91	R	89.1	Confident	81.4	Confident	83 Å²	83	46.9 Å²	46.9	31%	0.313	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	107.9	169	-177.1	177.6	-174.3	-116.5	0.7	107.7	E80 L82 V217 V218 E219	E80-R91 HydrophobicContact CB-CB 4.25Å; E80-R91 PolarHBondContact N-O 3.2Å; E80-R91 PolarHBondContact O-N 3.49Å; E80-R91 IonicContact OE2-CZ 3.94Å; E80-R91 IonicContact OE2-NH1 2.76Å; E80-R91 PolarHBondContact OE2-NH1 3.11Å; L82-R91 HydrophobicContact CD1-CB 3.4Å; L82-R91 VanDerWaalsContact CD1-CB 3.4Å; L82-R91 HydrophobicContact CD1-CG 4.31Å; R91-V217 HydrophobicContact CG-CG1 3.75Å; R91-V218 CarbonylContact C-O 3.52Å; R91-V218 WeakPolarHBondContact CA-O 3.25Å; R91-E219 HydrophobicContact CB-CG 4.23Å; R91-E219 HydrophobicContact CG-CG 4.1Å
92	A	88.2	Confident	81.5	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.5	-179.7	0	0	0	0	0	110.2	L79 L94 V217 V218 I296	L79-A92 HydrophobicContact CD2-CB 3.47Å; L79-A92 VanDerWaalsContact CD2-CB 3.47Å; A92-L94 HydrophobicContact CB-CD2 4.07Å; A92-L94 HydrophobicContact CB-CG 4.12Å; A92-V217 WeakPolarHBondContact O-CA 3.46Å; A92-V218 PolarHBondContact N-O 3.47Å; A92-V218 PolarHBondContact O-N 3.37Å; A92-I296 HydrophobicContact CB-CD1 4.04Å
93	S	89.4	Confident	81.1	Confident	27 Å²	27	45.8 Å²	45.8	19%	0.189	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	115	164.3	-58.3	0	0	0	0	107.8	D77 N78	D77-S93 PolarHBondContact N-O 2.86Å; N78-S93 PolarHBondContact O-N 3.24Å
94	L	88.1	Confident	81.2	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.7	-177	-56.3	178.9	0	0	0	109.3	V74 S75 V76 A92 S215 I216 V218 V238	V74-L94 HydrophobicContact CG1-CB 4.45Å; V74-L94 HydrophobicContact CG1-CD2 4.36Å; S75-L94 WeakPolarHBondContact O-CA 3.19Å; V76-L94 HydrophobicContact CB-CD2 4.26Å; V76-L94 HydrophobicContact CG1-CD2 4.12Å; V76-L94 HydrophobicContact CG2-CD2 3.73Å; A92-L94 HydrophobicContact CB-CD2 4.07Å; A92-L94 HydrophobicContact CB-CG 4.12Å; L94-S215 WeakPolarHBondContact O-CA 3.4Å; L94-I216 PolarHBondContact N-O 3.11Å; L94-I216 PolarHBondContact O-N 2.96Å; L94-I216 VanDerWaalsContact O-O 3.14Å; L94-V218 HydrophobicContact CD1-CG2 3.65Å; L94-V218 HydrophobicContact CG-CG2 4.14Å; L94-V238 HydrophobicContact CD1-CG1 4.05Å
95	T	88.2	Confident	81.3	Confident	9 Å²	9	45.2 Å²	45.2	6%	0.055	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.8	164.8	-58.3	0	0	0	0	109.5	V74 S75 D77 F97 M213 E214 S215	V74-T95 CarbonylContact C-O 3.57Å; V74-T95 WeakPolarHBondContact CA-O 3.48Å; S75-T95 PolarHBondContact N-O 2.96Å; S75-T95 PolarHBondContact O-N 3.45Å; S75-T95 WeakPolarHBondContact OG-CB 3.34Å; D77-T95 WeakPolarHBondContact OD2-CB 3.28Å; D77-T95 PolarHBondContact OD2-N 3.12Å; D77-T95 PolarHBondContact OD2-OG1 3.08Å; T95-F97 HydrophobicContact CG2-CD2 4.35Å; T95-F97 HydrophobicContact CG2-CE1 4.01Å; T95-F97 HydrophobicContact CG2-CE2 3.69Å; T95-F97 HydrophobicContact CG2-CZ 3.5Å; T95-F97 WeakPolarHBondContact O-CD2 3.47Å; T95-F97 WeakPolarHBondContact O-CE2 3.47Å; T95-M213 HydrophobicContact CG2-CG 3.62Å; T95-M213 HydrophobicContact CG2-SD 4.31Å; T95-E214 WeakPolarHBondContact CA-O 3.39Å; T95-S215 WeakPolarHBondContact CG2-OG 3.44Å; T95-S215 PolarHBondContact OG1-OG 3.34Å
96	L	87.5	Confident	81.5	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	133.6	-179.8	-49.4	-178.8	0	0	0	108.7	V74 L132 M213 E214 I216 I240	V74-L96 HydrophobicContact CB-CD2 4.32Å; V74-L96 HydrophobicContact CG1-CD2 3.92Å; V74-L96 HydrophobicContact CG2-CD2 3.63Å; L96-L132 HydrophobicContact CB-CD1 4.43Å; L96-L132 HydrophobicContact CD1-CB 4.3Å; L96-L132 HydrophobicContact CD1-CD1 3.77Å; L96-M213 CarbonylContact O-C 3.54Å; L96-M213 VanDerWaalsContact O-CA 3.3Å; L96-M213 WeakPolarHBondContact O-CA 3.45Å; L96-E214 PolarHBondContact N-O 3.14Å; L96-E214 PolarHBondContact O-N 2.91Å; L96-I216 HydrophobicContact CD1-CD1 3.8Å; L96-I240 HydrophobicContact CD1-CD1 4.45Å; L96-I240 HydrophobicContact CD2-CD1 3.65Å
97	F	87.5	Confident	81.7	Confident	59 Å²	59	37.1 Å²	37.1	26%	0.259	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	113.1	178.1	-51.7	-101.9	0	0	0	109.6	L72 S73 T95 F212 M213	L72-F97 WeakPolarHBondContact CD1-O 3.44Å; S73-F97 PolarHBondContact N-O 3.02Å; S73-F97 PolarHBondContact O-N 3.03Å; S73-F97 PolarHBondContact OG-O 3.17Å; T95-F97 HydrophobicContact CG2-CD2 4.35Å; T95-F97 HydrophobicContact CG2-CE1 4.01Å; T95-F97 HydrophobicContact CG2-CE2 3.69Å; T95-F97 HydrophobicContact CG2-CZ 3.5Å; T95-F97 WeakPolarHBondContact O-CD2 3.47Å; T95-F97 WeakPolarHBondContact O-CE2 3.47Å; F97-F212 CarbonylContact C-O 3.49Å; F97-F212 WeakPolarHBondContact CA-O 3.45Å; F97-M213 HydrophobicContact CD1-CB 4.3Å; F97-M213 HydrophobicContact CD1-CE 4.04Å; F97-M213 HydrophobicContact CD1-CG 3.8Å; F97-M213 HydrophobicContact CD1-SD 4.4Å; F97-M213 HydrophobicContact CE1-CE 3.72Å; F97-M213 HydrophobicContact CE1-CG 3.7Å; F97-M213 HydrophobicContact CE1-SD 3.83Å; F97-M213 HydrophobicContact CZ-CG 4.47Å
98	A	85.8	Confident	81.6	Confident	2 Å²	2	33.6 Å²	33.6	2%	0.017	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.7	177.6	0	0	0	0	0	110.3	I70 E71 L72 W100 P130 S211 F212	I70-A98 HydrophobicContact CG2-CB 3.92Å; E71-A98 CarbonylContact O-C 3.53Å; E71-A98 WeakPolarHBondContact O-CA 3.22Å; L72-A98 HydrophobicContact CD1-CB 3.97Å; A98-W100 HydrophobicContact CB-CE3 4.36Å; A98-W100 HydrophobicContact CB-CZ3 4.16Å; A98-P130 HydrophobicContact CB-CG 4.11Å; A98-S211 CarbonylContact O-C 3.45Å; A98-S211 WeakPolarHBondContact O-CA 3.37Å; A98-F212 HydrophobicContact CB-CB 4.36Å; A98-F212 PolarHBondContact N-O 3.49Å; A98-F212 PolarHBondContact O-N 3.42Å
99	E	84.9	Confident	81.1	Confident	48 Å²	48	39.2 Å²	39.2	22%	0.224	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.2	174.8	-56.9	-171.4	130.6	0	0	110.1	E71 R150 Y210 K258	E71-E99 HydrophobicContact CB-CB 4.38Å; E71-E99 PolarHBondContact N-O 3.43Å; E71-E99 PolarHBondContact O-N 3.22Å; E99-R150 IonicContact OE1-NH1 3.43Å; E99-R150 PolarHBondContact OE1-NH1 3Å; E99-Y210 CarbonylContact C-O 3.55Å; E99-Y210 VanDerWaalsContact CA-O 3.28Å; E99-Y210 WeakPolarHBondContact CA-O 3.35Å; E99-K258 IonicContact OE2-NZ 2.77Å; E99-K258 PolarHBondContact OE2-NZ 3.39Å
100	W	83.6	Confident	80.2	Confident	11 Å²	11	39.6 Å²	39.6	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	147.1	175	68.8	93.2	0	0	0	112.6	I70 A98 W128 H129 P130 L147 N209 Y210 F212	I70-W100 HydrophobicContact CG1-CB 4.14Å; I70-W100 HydrophobicContact CG2-CE3 4.36Å; A98-W100 HydrophobicContact CB-CE3 4.36Å; A98-W100 HydrophobicContact CB-CZ3 4.16Å; W100-W128 HydrophobicContact CZ2-CE3 4.45Å; W100-W128 HydrophobicContact CZ2-CZ3 4.29Å; W100-H129 HydrophobicContact CH2-CB 4.11Å; W100-P130 HydrophobicContact CH2-CG 4.38Å; W100-P130 VanDerWaalsContact CZ3-CD 3.49Å; W100-P130 HydrophobicContact CZ3-CG 3.99Å; W100-L147 HydrophobicContact CH2-CD1 3.8Å; W100-L147 HydrophobicContact CZ2-CD1 4.35Å; W100-N209 WeakPolarHBondContact O-CA 3.48Å; W100-Y210 AromaticContact CD1-CD2 3.65Å; W100-Y210 VanDerWaalsContact CE2-CB 3.42Å; W100-Y210 AromaticContact CE2-CD2 3.84Å; W100-Y210 AromaticContact CE2-CG 3.8Å; W100-Y210 HydrophobicContact CG-CD2 4.48Å; W100-Y210 HydrophobicContact CZ2-CD2 4.37Å; W100-Y210 AromaticContact CZ2-CG 3.97Å; W100-Y210 HydrophobicContact CZ2-CG 3.97Å; W100-Y210 PolarHBondContact N-O 3.41Å; W100-Y210 AromaticContact NE1-CD2 3.19Å; W100-Y210 AromaticContact NE1-CE2 3.94Å; W100-Y210 AromaticContact NE1-CG 3.66Å; W100-Y210 PolarHBondContact O-N 3.27Å; W100-F212 HydrophobicContact CH2-CB 3.92Å; W100-F212 HydrophobicContact CZ3-CB 3.67Å
101	P	82.5	Confident	79.2	Confident	60 Å²	60	43.5 Å²	43.5	39%	0.39	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	147.1	-177.4	28.4	-35.5	0	0	0	112.9	T103 N209	P101-T103 PolarHBondContact O-N 2.8Å; P101-N209 VanDerWaalsContact CA-OD1 3.3Å; P101-N209 WeakPolarHBondContact CA-OD1 3.43Å
102	V	78.1	Confident	78.2	Confident	17 Å²	17	40.2 Å²	40.2	10%	0.103	22%	0.218	C	C	.	.			trans	-74	121.1	171.9	177.4	0	0	0	0	109.8	V107 T108 L149 P208 Y210	V102-V107 HydrophobicContact CG1-CB 3.72Å; V102-V107 HydrophobicContact CG1-CG1 3.77Å; V102-T108 HydrophobicContact CB-CG2 3.88Å; V102-T108 HydrophobicContact CG1-CG2 3.57Å; V102-L149 HydrophobicContact CG2-CD1 3.45Å; V102-L149 VanDerWaalsContact CG2-CD1 3.45Å; V102-P208 HydrophobicContact CB-CG 4.41Å; V102-P208 WeakPolarHBondContact CB-O 3.47Å; V102-P208 HydrophobicContact CG2-CB 4.47Å; V102-P208 HydrophobicContact CG2-CG 4.23Å; V102-P208 WeakPolarHBondContact CG2-O 3.48Å; V102-P208 PolarHBondContact N-O 2.95Å; V102-Y210 HydrophobicContact CB-CE2 4.08Å; V102-Y210 HydrophobicContact CG1-CE2 4.26Å; V102-Y210 HydrophobicContact CG2-CD2 3.69Å; V102-Y210 HydrophobicContact CG2-CE2 3.49Å; V102-Y210 VanDerWaalsContact CG2-CE2 3.49Å; V102-Y210 HydrophobicContact CG2-CG 4.39Å
103	T	71.7	Confident	77.2	Confident	83 Å²	83	40.2 Å²	40.2	51%	0.509	22%	0.217	S	C	.	.			trans	-97.9	-9.5	-176.2	59.9	0	0	0	0	114.6	L62 P101	L62-T103 HydrophobicContact CD1-CG2 4.18Å; L62-T103 HydrophobicContact CD2-CG2 3.86Å; P101-T103 PolarHBondContact O-N 2.8Å
104	D	73.2	Confident	76.1	Confident	44 Å²	44	43.8 Å²	43.8	24%	0.235	24%	0.235	C	C	.	.			trans	-103.1	116.4	179.6	-165.1	-47.4	0	0	0	110	R106 V107 T108	D104-R106 PolarHBondContact O-N 3.32Å; D104-R106 VanDerWaalsContact O-N 3.1Å; D104-R106 VanDerWaalsContact OD1-CB 3.27Å; D104-R106 WeakPolarHBondContact OD1-CB 3.37Å; D104-R106 WeakPolarHBondContact OD1-CG 3.38Å; D104-R106 IonicContact OD1-CZ 3.75Å; D104-R106 PolarHBondContact OD1-N 2.93Å; D104-R106 IonicContact OD1-NE 2.89Å; D104-R106 PolarHBondContact OD1-NE 2.94Å; D104-R106 IonicContact OD1-NH2 3.76Å; D104-R106 IonicContact OD2-CZ 3.41Å; D104-R106 IonicContact OD2-NE 3.35Å; D104-R106 PolarHBondContact OD2-NE 3.39Å; D104-R106 IonicContact OD2-NH2 2.67Å; D104-R106 PolarHBondContact OD2-NH2 3.47Å; D104-V107 HydrophobicContact CB-CG2 4.34Å; D104-V107 PolarHBondContact O-N 2.96Å; D104-T108 PolarHBondContact O-N 3.33Å
105	S	73.5	Confident	74.8	Confident	67 Å²	67	49.6 Å²	49.6	47%	0.469	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-22	-176	68.8	0	0	0	0	113.2	V107 T108 E109	S105-V107 VanDerWaalsContact C-N 3.28Å; S105-V107 PolarHBondContact O-N 3.17Å; S105-T108 VanDerWaalsContact CA-OG1 3.31Å; S105-T108 WeakPolarHBondContact CA-OG1 3.34Å; S105-T108 PolarHBondContact O-N 3.24Å; S105-T108 PolarHBondContact O-OG1 3Å; S105-E109 VanDerWaalsContact O-CB 3.28Å; S105-E109 WeakPolarHBondContact O-CB 3.47Å; S105-E109 WeakPolarHBondContact O-CG 3.37Å; S105-E109 PolarHBondContact O-N 3.43Å
106	R	72.3	Confident	73.8	Confident	126 Å²	126	51.1 Å²	51.1	48%	0.475	28%	0.277	S	S	.	.	H	α-helix	trans	-70.7	-28	177.3	-57.8	171.3	-67.7	171	4.6	111.9	Y52 D104 S110	Y52-R106 HydrophobicContact CD1-CB 4.39Å; Y52-R106 HydrophobicContact CG-CB 4.21Å; D104-R106 PolarHBondContact O-N 3.32Å; D104-R106 VanDerWaalsContact O-N 3.1Å; D104-R106 VanDerWaalsContact OD1-CB 3.27Å; D104-R106 WeakPolarHBondContact OD1-CB 3.37Å; D104-R106 WeakPolarHBondContact OD1-CG 3.38Å; D104-R106 IonicContact OD1-CZ 3.75Å; D104-R106 PolarHBondContact OD1-N 2.93Å; D104-R106 IonicContact OD1-NE 2.89Å; D104-R106 PolarHBondContact OD1-NE 2.94Å; D104-R106 IonicContact OD1-NH2 3.76Å; D104-R106 IonicContact OD2-CZ 3.41Å; D104-R106 IonicContact OD2-NE 3.35Å; D104-R106 PolarHBondContact OD2-NE 3.39Å; D104-R106 IonicContact OD2-NH2 2.67Å; D104-R106 PolarHBondContact OD2-NH2 3.47Å; R106-S110 PolarHBondContact O-N 3.32Å; R106-S110 PolarHBondContact O-OG 2.87Å
107	V	73.1	Confident	72.5	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-82.9	-33.3	174.3	179.6	0	0	0	0	110.5	L49 V102 D104 S105 L149	L49-V107 HydrophobicContact CD1-CG1 4.23Å; V102-V107 HydrophobicContact CG1-CB 3.72Å; V102-V107 HydrophobicContact CG1-CG1 3.77Å; D104-V107 HydrophobicContact CB-CG2 4.34Å; D104-V107 PolarHBondContact O-N 2.96Å; S105-V107 VanDerWaalsContact C-N 3.28Å; S105-V107 PolarHBondContact O-N 3.17Å; V107-L149 HydrophobicContact CG1-CD2 3.76Å
108	T	69.4	Low	71.4	Confident	46 Å²	46	52.8 Å²	52.8	28%	0.282	31%	0.311	S	S	.	.	H	α-helix	trans	-72.1	-32.9	174.1	66.1	0	0	0	0	113.2	V102 D104 S105 S110 P208	V102-T108 HydrophobicContact CB-CG2 3.88Å; V102-T108 HydrophobicContact CG1-CG2 3.57Å; D104-T108 PolarHBondContact O-N 3.33Å; S105-T108 VanDerWaalsContact CA-OG1 3.31Å; S105-T108 WeakPolarHBondContact CA-OG1 3.34Å; S105-T108 PolarHBondContact O-N 3.24Å; S105-T108 PolarHBondContact O-OG1 3Å; T108-S110 VanDerWaalsContact C-N 3.34Å; T108-P208 HydrophobicContact CG2-CG 3.85Å
109	E	66.7	Low	70.8	Confident	127 Å²	127	54.2 Å²	54.2	59%	0.593	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	12.5	178.6	-63	173.3	168.6	0	0	112.3	S105 T111	S105-E109 VanDerWaalsContact O-CB 3.28Å; S105-E109 WeakPolarHBondContact O-CB 3.47Å; S105-E109 WeakPolarHBondContact O-CG 3.37Å; S105-E109 PolarHBondContact O-N 3.43Å; E109-T111 PolarHBondContact O-N 3.46Å
110	S	65.9	Low	70.6	Confident	18 Å²	18	52.3 Å²	52.3	13%	0.126	32%	0.318	C	S	.	.			trans	-78.7	113.2	179.6	-83.2	0	0	0	0	112	R106 T108 L112 V113	R106-S110 PolarHBondContact O-N 3.32Å; R106-S110 PolarHBondContact O-OG 2.87Å; T108-S110 VanDerWaalsContact C-N 3.34Å; S110-L112 PolarHBondContact O-N 3.22Å; S110-V113 WeakPolarHBondContact O-CB 3.45Å; S110-V113 PolarHBondContact O-N 3.44Å
111	T	64.6	Low	70.6	Confident	82 Å²	82	59.6 Å²	59.6	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-52.5	-28.5	-177	56.5	0	0	0	0	115.1	E109 V113 D114 M115	E109-T111 PolarHBondContact O-N 3.46Å; T111-V113 PolarHBondContact O-N 2.83Å; T111-D114 PolarHBondContact O-N 3.2Å; T111-M115 WeakPolarHBondContact O-CB 3.35Å; T111-M115 WeakPolarHBondContact O-CG 3.42Å; T111-M115 PolarHBondContact O-N 3.05Å
112	L	67.8	Low	70.6	Confident	14 Å²	14	57.2 Å²	57.2	7%	0.073	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-31.2	175.5	-174.3	62.5	0	0	0	112.7	L42 L45 W46 L49 S110 A116	L42-L112 HydrophobicContact CD1-CD1 3.74Å; L45-L112 HydrophobicContact CB-CB 4.46Å; L45-L112 HydrophobicContact CB-CD1 4.25Å; L45-L112 HydrophobicContact CB-CD2 4.3Å; L45-L112 HydrophobicContact CD1-CD1 4.38Å; W46-L112 HydrophobicContact CD2-CD2 4.16Å; W46-L112 HydrophobicContact CE3-CD2 4.38Å; W46-L112 HydrophobicContact CG-CD2 4.47Å; L49-L112 HydrophobicContact CD2-CD2 4.04Å; S110-L112 PolarHBondContact O-N 3.22Å; L112-A116 WeakPolarHBondContact O-CB 3.49Å; L112-A116 PolarHBondContact O-N 3.26Å
113	V	67	Low	70.9	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	34%	0.339	C	S	.	.	H	α-helix	trans	-72.2	-39.5	180	-176.5	0	0	0	0	111	S110 T111 L149 N151	S110-V113 WeakPolarHBondContact O-CB 3.45Å; S110-V113 PolarHBondContact O-N 3.44Å; T111-V113 PolarHBondContact O-N 2.83Å; V113-L149 HydrophobicContact CG2-CD2 3.6Å; V113-L149 HydrophobicContact CG2-CG 4.31Å; V113-N151 HydrophobicContact CG1-CB 3.92Å
114	D	67	Low	71.5	Confident	103 Å²	103	56 Å²	56	55%	0.551	32%	0.319	S	S	*	.	H	α-helix	trans	-73.1	-43	176.5	-64.6	-31.1	0	0	0	111.4	T111 A116 G117 N151	T111-D114 PolarHBondContact O-N 3.2Å; D114-A116 PolarHBondContact O-N 3.45Å; D114-G117 PolarHBondContact O-N 3.19Å; D114-N151 PolarHBondContact OD1-ND2 3.03Å
115	M	61.4	Low	72	Confident	123 Å²	123	60.1 Å²	60.1	61%	0.606	34%	0.341	S	S	*	.	H	α-helix	trans	-64.4	-27	175.4	-70.7	-173	-66.5	0	0	113.2	L45 T111 G117	L45-M115 HydrophobicContact CD1-CE 3.58Å; L45-M115 HydrophobicContact CD2-CE 4.38Å; T111-M115 WeakPolarHBondContact O-CB 3.35Å; T111-M115 WeakPolarHBondContact O-CG 3.42Å; T111-M115 PolarHBondContact O-N 3.05Å; M115-G117 VanDerWaalsContact C-N 3.29Å; M115-G117 PolarHBondContact O-N 3.44Å
116	A	66.4	Low	72.4	Confident	42 Å²	42	62.5 Å²	62.5	35%	0.347	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-6.9	177.8	0	0	0	0	0	114.5	L112 D114 G118 V120	L112-A116 WeakPolarHBondContact O-CB 3.49Å; L112-A116 PolarHBondContact O-N 3.26Å; D114-A116 PolarHBondContact O-N 3.45Å; A116-G118 PolarHBondContact O-N 3.11Å; A116-V120 HydrophobicContact CB-CG2 3.51Å
117	G	59.7	Low	72.9	Confident	60 Å²	60	56.6 Å²	56.6	62%	0.619	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	17	162.9	0	0	0	0	0	117.6	D114 M115 A154	D114-G117 PolarHBondContact O-N 3.19Å; M115-G117 VanDerWaalsContact C-N 3.29Å; M115-G117 PolarHBondContact O-N 3.44Å; G117-A154 WeakPolarHBondContact O-CB 3.29Å
118	G	64.1	Low	73.4	Confident	34 Å²	34	58 Å²	58	35%	0.351	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	168.9	-36.2	-177.8	0	0	0	0	0	114.4	A116	A116-G118 PolarHBondContact O-N 3.11Å
119	G	74.3	Confident	74	Confident	33 Å²	33	57 Å²	57	34%	0.34	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	165.9	157.7	168.1	0	0	0	0	0	115.6	L149	G119-L149 CarbonylContact C-O 3.56Å; G119-L149 WeakPolarHBondContact CA-O 3.37Å
120	V	79.7	Confident	74.6	Confident	8 Å²	8	51.1 Å²	51.1	5%	0.048	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.4	-176.9	178.3	0	0	0	0	109.4	W46 L49 A116 L122 E148 L149	W46-V120 HydrophobicContact CH2-CG1 3.23Å; W46-V120 HydrophobicContact CZ2-CG1 3.83Å; W46-V120 HydrophobicContact CZ3-CG1 3.84Å; L49-V120 HydrophobicContact CD2-CG1 4.47Å; A116-V120 HydrophobicContact CB-CG2 3.51Å; V120-L122 HydrophobicContact CG1-CD2 4.1Å; V120-L122 PolarHBondContact O-N 3.44Å; V120-E148 CarbonylContact O-C 3.59Å; V120-E148 WeakPolarHBondContact O-CA 3.37Å; V120-L149 HydrophobicContact CB-CB 4.45Å; V120-L149 PolarHBondContact N-O 3.43Å; V120-L149 PolarHBondContact O-N 2.93Å
121	R	83.7	Confident	75.2	Confident	163 Å²	163	54.8 Å²	54.8	62%	0.615	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	117.9	173.4	-85.1	-176.5	167.7	109.5	-16.2	110.3	W46 E148	W46-R121 VanDerWaalsContact CH2-O 3.3Å; W46-R121 WeakPolarHBondContact CH2-O 3.41Å; R121-E148 HydrophobicContact CG-CG 4.32Å; R121-E148 WeakPolarHBondContact CG-OE1 3.37Å; R121-E148 IonicContact NE-OE1 3.67Å
122	L	83.9	Confident	76	Confident	10 Å²	10	51 Å²	51	5%	0.052	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.8	179.8	-60.8	178.1	0	0	0	111.2	W46 L49 L53 V120 V124 V127 L147 L149 Y210	W46-L122 HydrophobicContact CH2-CD2 4.41Å; W46-L122 HydrophobicContact CZ3-CD2 3.96Å; L49-L122 HydrophobicContact CD2-CD2 4.27Å; L53-L122 HydrophobicContact CD1-CD1 4.37Å; L53-L122 HydrophobicContact CD1-CD2 3.89Å; L53-L122 HydrophobicContact CD2-CD1 3.94Å; V120-L122 HydrophobicContact CG1-CD2 4.1Å; V120-L122 PolarHBondContact O-N 3.44Å; L122-V124 PolarHBondContact O-N 3.08Å; L122-V127 HydrophobicContact CB-CG2 4.39Å; L122-V127 HydrophobicContact CD1-CG2 4.48Å; L122-L147 HydrophobicContact CB-CB 4.24Å; L122-L147 HydrophobicContact CB-CD2 3.89Å; L122-L147 HydrophobicContact CB-CG 4Å; L122-L147 HydrophobicContact CD1-CD2 4.05Å; L122-L147 HydrophobicContact CD1-CG 4.22Å; L122-L147 PolarHBondContact N-O 3.36Å; L122-L149 HydrophobicContact CD1-CB 4.14Å; L122-L149 HydrophobicContact CG-CB 4.47Å; L122-Y210 HydrophobicContact CD1-CD1 4.12Å; L122-Y210 HydrophobicContact CD1-CE1 3.91Å
123	D	83.7	Confident	76.7	Confident	58 Å²	58	52.5 Å²	52.5	31%	0.31	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-69.9	124	169.3	-173.6	-3.2	0	0	0	109.9	Y50 D125 K126	Y50-D123 VanDerWaalsContact OH-CB 3.25Å; Y50-D123 WeakPolarHBondContact OH-CB 3.47Å; Y50-D123 PolarHBondContact OH-N 3.09Å; D123-D125 PolarHBondContact OD1-N 3.37Å; D123-K126 HydrophobicContact CB-CB 4.32Å; D123-K126 HydrophobicContact CB-CD 4.28Å; D123-K126 HydrophobicContact CB-CG 4.26Å; D123-K126 PolarHBondContact O-N 3.04Å; D123-K126 IonicContact OD2-NZ 2.71Å; D123-K126 PolarHBondContact OD2-NZ 3.24Å
124	V	84.5	Confident	77.5	Confident	16 Å²	16	53.2 Å²	53.2	10%	0.097	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-68.5	-41.3	-170.7	-176.5	0	0	0	0	111	L122 K126 V127 Q145 L147 F212	L122-V124 PolarHBondContact O-N 3.08Å; V124-K126 PolarHBondContact O-N 3.4Å; V124-V127 PolarHBondContact O-N 3Å; V124-V127 VanDerWaalsContact O-O 3.1Å; V124-Q145 HydrophobicContact CG2-CB 4.21Å; V124-L147 HydrophobicContact CG2-CB 4.08Å; V124-F212 HydrophobicContact CG1-CE2 3.91Å
125	D	83	Confident	78.2	Confident	132 Å²	132	53.5 Å²	53.5	71%	0.706	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-69.4	-18.7	-176.8	-69.6	-35.7	0	0	0	112.9	D123	D123-D125 PolarHBondContact OD1-N 3.37Å
126	K	82.3	Confident	79	Confident	117 Å²	117	50.4 Å²	50.4	51%	0.509	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-93.6	-13.6	-177.3	-67.1	-169.4	176.6	84.7	0	114	Y50 D123 V124	Y50-K126 HydrophobicContact CD1-CB 4.18Å; Y50-K126 HydrophobicContact CD1-CD 4.24Å; Y50-K126 HydrophobicContact CE1-CB 3.74Å; Y50-K126 HydrophobicContact CE1-CD 3.9Å; Y50-K126 HydrophobicContact CE1-CG 4.46Å; D123-K126 HydrophobicContact CB-CB 4.32Å; D123-K126 HydrophobicContact CB-CD 4.28Å; D123-K126 HydrophobicContact CB-CG 4.26Å; D123-K126 PolarHBondContact O-N 3.04Å; D123-K126 IonicContact OD2-NZ 2.71Å; D123-K126 PolarHBondContact OD2-NZ 3.24Å; V124-K126 PolarHBondContact O-N 3.4Å
127	V	82.5	Confident	79.7	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	29%	0.285	C	S	.	.	S	Bend	trans	-128.3	137.7	-170.1	-174.8	0	0	0	0	110.6	Y50 L53 P54 L122 V124 H129 L147	Y50-V127 HydrophobicContact CE1-CG2 4.02Å; L53-V127 HydrophobicContact CB-CG1 4.49Å; L53-V127 HydrophobicContact CB-CG2 4.24Å; L53-V127 HydrophobicContact CD1-CG2 3.89Å; L53-V127 HydrophobicContact CD2-CG1 4.07Å; L53-V127 HydrophobicContact CD2-CG2 4.41Å; L53-V127 HydrophobicContact CG-CG2 4.41Å; P54-V127 HydrophobicContact CG-CG1 4.45Å; P54-V127 CarbonylContact O-C 3.54Å; P54-V127 WeakPolarHBondContact O-CA 3.46Å; L122-V127 HydrophobicContact CB-CG2 4.39Å; L122-V127 HydrophobicContact CD1-CG2 4.48Å; V124-V127 PolarHBondContact O-N 3Å; V124-V127 VanDerWaalsContact O-O 3.1Å; V127-H129 PolarHBondContact O-N 3.39Å; V127-L147 HydrophobicContact CB-CD2 3.71Å; V127-L147 HydrophobicContact CG1-CD2 3.75Å; V127-L147 HydrophobicContact CG2-CD2 4.4Å
128	W	83.2	Confident	80.6	Confident	31 Å²	31	52.1 Å²	52.1	12%	0.117	28%	0.28	C	S	.	.			trans	-61.6	129	174.3	-178	85.4	0	0	0	111.5	P54 P60 I70 W100 P130 P250	P54-W128 HydrophobicContact CB-CB 4.07Å; P54-W128 HydrophobicContact CG-CB 4.09Å; P54-W128 PolarHBondContact O-N 3.05Å; P60-W128 HydrophobicContact CG-CE3 4.44Å; P60-W128 HydrophobicContact CG-CH2 4.34Å; P60-W128 HydrophobicContact CG-CZ3 4.09Å; I70-W128 HydrophobicContact CD1-CH2 4.17Å; W100-W128 HydrophobicContact CZ2-CE3 4.45Å; W100-W128 HydrophobicContact CZ2-CZ3 4.29Å; W128-P130 HydrophobicContact CH2-CB 4.48Å; W128-P250 HydrophobicContact CH2-CG 4Å; W128-P250 HydrophobicContact CZ2-CG 4.36Å
129	H	82.9	Confident	81.5	Confident	25 Å²	25	56.5 Å²	56.5	12%	0.116	29%	0.286	C	S	.	.			trans	-135.2	158.3	172.4	69.2	90.4	0	0	0	109.2	W100 V127 Q131 F212	W100-H129 HydrophobicContact CH2-CB 4.11Å; V127-H129 PolarHBondContact O-N 3.39Å; H129-Q131 PolarHBondContact O-N 3.12Å; H129-F212 HydrophobicContact CB-CD2 4.23Å; H129-F212 HydrophobicContact CB-CE2 4.4Å; H129-F212 HydrophobicContact CB-CG 4.48Å; H129-F212 AromaticContact CE1-CZ 3.94Å; H129-F212 AromaticContact ND1-CE1 3.95Å; H129-F212 AromaticContact ND1-CE2 3.84Å; H129-F212 AromaticContact ND1-CZ 3.57Å
130	P	78.5	Confident	81.9	Confident	2 Å²	2	60 Å²	60	1%	0.013	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-63.8	130.2	172.4	26.5	-33.4	0	0	0	110.3	I70 A98 W100 W128	I70-P130 HydrophobicContact CD1-CB 4.05Å; I70-P130 HydrophobicContact CD1-CG 4.28Å; A98-P130 HydrophobicContact CB-CG 4.11Å; W100-P130 HydrophobicContact CH2-CG 4.38Å; W100-P130 VanDerWaalsContact CZ3-CD 3.49Å; W100-P130 HydrophobicContact CZ3-CG 3.99Å; W128-P130 HydrophobicContact CH2-CB 4.48Å
131	Q	80.2	Confident	82.1	Confident	95 Å²	95	62 Å²	62	44%	0.444	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.6	172.4	-69.7	-174.9	-15.2	0	0	109.4	H129 E243	H129-Q131 PolarHBondContact O-N 3.12Å; Q131-E243 PolarHBondContact O-N 2.86Å
132	L	80.2	Confident	82.2	Confident	3 Å²	3	60 Å²	60	2%	0.016	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.8	179.9	-60.2	176.9	0	0	0	109.8	L72 L96 R142 I240 I252	L72-L132 HydrophobicContact CD1-CD1 3.89Å; L72-L132 HydrophobicContact CD2-CD1 3.78Å; L72-L132 HydrophobicContact CD2-CD2 4.04Å; L96-L132 HydrophobicContact CB-CD1 4.43Å; L96-L132 HydrophobicContact CD1-CB 4.3Å; L96-L132 HydrophobicContact CD1-CD1 3.77Å; L132-R142 PolarHBondContact O-NH2 2.98Å; L132-R142 VanDerWaalsContact O-NH2 3.1Å; L132-I240 HydrophobicContact CB-CG2 4.16Å; L132-I240 HydrophobicContact CD1-CG2 4.48Å; L132-I240 HydrophobicContact CD2-CG2 4.26Å; L132-I252 HydrophobicContact CD2-CD1 4.02Å
133	V	82.6	Confident	82	Confident	46 Å²	46	64.9 Å²	64.9	28%	0.279	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.1	-179.7	171.6	0	0	0	0	109.3	K135 K241 E243	V133-K135 PolarHBondContact O-N 3.39Å; V133-K241 PolarHBondContact N-O 2.76Å; V133-K241 PolarHBondContact O-N 3.48Å; V133-E243 HydrophobicContact CB-CB 4.33Å; V133-E243 HydrophobicContact CG2-CB 3.62Å; V133-E243 HydrophobicContact CG2-CG 4.39Å; V133-E243 WeakPolarHBondContact CG2-OE2 3.2Å
134	I	84.5	Confident	82	Confident	16 Å²	16	68.6 Å²	68.6	8%	0.082	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	97.7	-178.2	-55.9	-179.5	0	0	0	108.7	G136 A137 I216 V218 V238 W239 I240	I134-G136 PolarHBondContact O-N 3.47Å; I134-A137 HydrophobicContact CG2-CB 4.18Å; I134-I216 HydrophobicContact CD1-CD1 4.16Å; I134-I216 HydrophobicContact CD1-CG2 4.48Å; I134-V218 HydrophobicContact CB-CG1 4.17Å; I134-V218 HydrophobicContact CD1-CB 4.35Å; I134-V218 HydrophobicContact CD1-CG1 3.6Å; I134-V218 HydrophobicContact CD1-CG2 3.84Å; I134-V218 HydrophobicContact CG1-CG1 4.42Å; I134-V218 HydrophobicContact CG2-CG1 4.11Å; I134-V238 HydrophobicContact CG2-CG1 3.58Å; I134-W239 CarbonylContact C-O 3.56Å; I134-W239 VanDerWaalsContact CA-O 3.31Å; I134-W239 WeakPolarHBondContact CA-O 3.39Å; I134-I240 HydrophobicContact CG1-CG1 4.39Å
135	K	80.8	Confident	82.2	Confident	108 Å²	108	71.4 Å²	71.4	47%	0.47	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	131.1	179.8	-83.2	-166.6	169.7	-170.3	0	110.3	V133 W239	V133-K135 PolarHBondContact O-N 3.39Å; K135-W239 HydrophobicContact CB-CB 4.17Å; K135-W239 PolarHBondContact N-O 2.96Å
136	G	77.7	Confident	82.4	Confident	58 Å²	58	69.4 Å²	69.4	60%	0.598	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	1.6	176.5	0	0	0	0	0	115.7	I134 P221	I134-G136 PolarHBondContact O-N 3.47Å; G136-P221 WeakPolarHBondContact O-CD 3.31Å
137	A	82.3	Confident	82.7	Confident	24 Å²	24	63.9 Å²	63.9	20%	0.198	30%	0.303	C	S	.	.			trans	-66.9	135.1	170.3	0	0	0	0	0	111.3	I134 V218 E219 V220	I134-A137 HydrophobicContact CG2-CB 4.18Å; A137-V218 HydrophobicContact CB-CG1 3.83Å; A137-E219 CarbonylContact C-O 3.44Å; A137-E219 WeakPolarHBondContact CA-O 3.44Å; A137-V220 HydrophobicContact CB-CG2 4.29Å
138	F	78.7	Confident	82.8	Confident	115 Å²	115	64.7 Å²	64.7	50%	0.504	31%	0.306	S	S	.	.	S	Bend	trans	-72.8	-35.9	171.5	178.9	-98.1	0	0	0	111.5	H84 E219	H84-F138 AromaticContact CD2-CE1 3.61Å; H84-F138 AromaticContact CD2-CZ 3.68Å; H84-F138 AromaticContact NE2-CE1 3.65Å; H84-F138 AromaticContact NE2-CZ 3.68Å; F138-E219 PolarHBondContact N-O 3.47Å
139	R	82.4	Confident	82.8	Confident	126 Å²	126	63.2 Å²	63.2	48%	0.475	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	144.9	174.5	-179.2	177.2	177.4	162.2	-1.8	109.4	D141 E219	R139-D141 WeakPolarHBondContact CG-OD1 3.35Å; R139-D141 IonicContact CZ-OD1 3.09Å; R139-D141 IonicContact CZ-OD2 3.68Å; R139-D141 VanDerWaalsContact CZ-OD2 3.3Å; R139-D141 VanDerWaalsContact NE-CG 3.34Å; R139-D141 IonicContact NE-OD1 2.73Å; R139-D141 PolarHBondContact NE-OD1 3.28Å; R139-D141 IonicContact NE-OD2 3.21Å; R139-D141 PolarHBondContact NE-OD2 2.83Å; R139-D141 IonicContact NH2-OD1 2.71Å; R139-D141 IonicContact NH2-OD2 2.92Å; R139-D141 PolarHBondContact NH2-OD2 2.88Å; R139-E219 HydrophobicContact CB-CB 4.08Å; R139-E219 HydrophobicContact CB-CG 4.33Å; R139-E219 WeakPolarHBondContact CB-OE2 3.46Å; R139-E219 PolarHBondContact N-O 3.29Å; R139-E219 PolarHBondContact O-N 3.2Å
140	H	82.3	Confident	82.7	Confident	106 Å²	106	66 Å²	66	49%	0.491	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	119.6	171.9	63	-83.2	0	0	0	109.3	I216 V217 V218	H140-I216 HydrophobicContact CB-CG2 4.38Å; H140-V217 WeakPolarHBondContact CA-O 3.32Å; H140-V218 HydrophobicContact CB-CG1 3.57Å
141	D	84.6	Confident	82.4	Confident	51 Å²	51	67 Å²	67	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	116.9	178.5	-71.1	15.2	0	0	0	107.8	R139 F143 I216 V217	R139-D141 WeakPolarHBondContact CG-OD1 3.35Å; R139-D141 IonicContact CZ-OD1 3.09Å; R139-D141 IonicContact CZ-OD2 3.68Å; R139-D141 VanDerWaalsContact CZ-OD2 3.3Å; R139-D141 VanDerWaalsContact NE-CG 3.34Å; R139-D141 IonicContact NE-OD1 2.73Å; R139-D141 PolarHBondContact NE-OD1 3.28Å; R139-D141 IonicContact NE-OD2 3.21Å; R139-D141 PolarHBondContact NE-OD2 2.83Å; R139-D141 IonicContact NH2-OD1 2.71Å; R139-D141 IonicContact NH2-OD2 2.92Å; R139-D141 PolarHBondContact NH2-OD2 2.88Å; D141-F143 HydrophobicContact CB-CD2 4.39Å; D141-F143 HydrophobicContact CB-CE2 3.49Å; D141-F143 VanDerWaalsContact CB-CE2 3.49Å; D141-F143 HydrophobicContact CB-CZ 3.88Å; D141-F143 VanDerWaalsContact O-CD2 3.28Å; D141-F143 WeakPolarHBondContact O-CD2 3.42Å; D141-F143 WeakPolarHBondContact O-CE2 3.44Å; D141-I216 WeakPolarHBondContact O-CA 3.44Å; D141-V217 PolarHBondContact N-O 2.94Å; D141-V217 PolarHBondContact O-N 3.21Å
142	R	85.4	Confident	81.4	Confident	119 Å²	119	66.9 Å²	66.9	45%	0.449	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.1	174.4	-71.3	172.5	164.6	137.2	2.8	109.2	L132 E214 I216	L132-R142 PolarHBondContact O-NH2 2.98Å; L132-R142 VanDerWaalsContact O-NH2 3.1Å; R142-E214 VanDerWaalsContact CD-OE1 3.23Å; R142-E214 WeakPolarHBondContact CD-OE1 3.44Å; R142-E214 IonicContact CZ-OE1 2.57Å; R142-E214 IonicContact NE-OE1 3.17Å; R142-E214 PolarHBondContact NE-OE1 2.8Å; R142-E214 IonicContact NH2-OE1 2.64Å; R142-I216 HydrophobicContact CG-CG1 4.36Å
143	F	79.1	Confident	80.1	Confident	113 Å²	113	73.8 Å²	73.8	50%	0.496	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-48.2	-176.6	-72.8	-90.5	0	0	0	113.2	D141 S215 V217	D141-F143 HydrophobicContact CB-CD2 4.39Å; D141-F143 HydrophobicContact CB-CE2 3.49Å; D141-F143 VanDerWaalsContact CB-CE2 3.49Å; D141-F143 HydrophobicContact CB-CZ 3.88Å; D141-F143 VanDerWaalsContact O-CD2 3.28Å; D141-F143 WeakPolarHBondContact O-CD2 3.42Å; D141-F143 WeakPolarHBondContact O-CE2 3.44Å; F143-S215 PolarHBondContact N-O 3.47Å; F143-V217 HydrophobicContact CD2-CB 4.47Å; F143-V217 HydrophobicContact CD2-CG2 3.9Å; F143-V217 HydrophobicContact CE2-CB 3.81Å; F143-V217 HydrophobicContact CE2-CG2 3.47Å; F143-V217 VanDerWaalsContact CE2-CG2 3.47Å; F143-V217 HydrophobicContact CZ-CG2 4.32Å
144	H	84.6	Confident	78.2	Confident	136 Å²	136	74.6 Å²	74.6	63%	0.63	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	132.1	-174.5	-60.1	-45	0	0	0	110.4	E214 S215	H144-E214 CarbonylContact O-C 3.56Å; H144-E214 WeakPolarHBondContact O-CA 3.2Å; H144-S215 PolarHBondContact O-N 2.87Å
145	Q	89	Confident	75.9	Confident	75 Å²	75	77.3 Å²	77.3	35%	0.35	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.8	169.7	-73.2	174.8	-15.6	0	0	108.2	V124 F212 M213 E214	V124-Q145 HydrophobicContact CG2-CB 4.21Å; Q145-F212 HydrophobicContact CB-CE2 4.3Å; Q145-F212 HydrophobicContact CG-CE2 4.42Å; Q145-F212 HydrophobicContact CG-CZ 4.17Å; Q145-M213 CarbonylContact C-O 3.57Å; Q145-M213 VanDerWaalsContact CA-O 3.31Å; Q145-M213 WeakPolarHBondContact CA-O 3.39Å; Q145-E214 HydrophobicContact CG-CB 4.26Å; Q145-E214 HydrophobicContact CG-CG 3.86Å; Q145-E214 PolarHBondContact NE2-OE1 3.2Å
146	R	87.6	Confident	73.6	Confident	91 Å²	91	76.1 Å²	76.1	34%	0.343	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	113	-179.1	177.3	178	177.5	-174.3	-8.5	109	E148 F212 M213	R146-E148 HydrophobicContact CG-CG 3.91Å; R146-E148 IonicContact CZ-OE1 2.67Å; R146-E148 IonicContact CZ-OE2 3.49Å; R146-E148 IonicContact NE-OE1 3.93Å; R146-E148 PolarHBondContact NE-OE1 3.38Å; R146-E148 IonicContact NE-OE2 2.69Å; R146-E148 IonicContact NH2-OE1 2.8Å; R146-E148 PolarHBondContact NH2-OE1 2.92Å; R146-E148 IonicContact NH2-OE2 2.56Å; R146-E148 PolarHBondContact NH2-OE2 3.46Å; R146-F212 WeakPolarHBondContact O-CA 3.48Å; R146-M213 HydrophobicContact CB-CB 4.38Å; R146-M213 PolarHBondContact N-O 2.97Å; R146-M213 PolarHBondContact O-N 3.24Å
147	L	87.7	Confident	71.3	Confident	1 Å²	1	81.2 Å²	81.2	1%	0.005	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.9	170.8	-175	64.5	0	0	0	109	W100 L122 V124 V127 F212	W100-L147 HydrophobicContact CH2-CD1 3.8Å; W100-L147 HydrophobicContact CZ2-CD1 4.35Å; L122-L147 HydrophobicContact CB-CB 4.24Å; L122-L147 HydrophobicContact CB-CD2 3.89Å; L122-L147 HydrophobicContact CB-CG 4Å; L122-L147 HydrophobicContact CD1-CD2 4.05Å; L122-L147 HydrophobicContact CD1-CG 4.22Å; L122-L147 PolarHBondContact N-O 3.36Å; V124-L147 HydrophobicContact CG2-CB 4.08Å; V127-L147 HydrophobicContact CB-CD2 3.71Å; V127-L147 HydrophobicContact CG1-CD2 3.75Å; V127-L147 HydrophobicContact CG2-CD2 4.4Å; L147-F212 HydrophobicContact CB-CD2 4.29Å; L147-F212 HydrophobicContact CD1-CB 3.91Å; L147-F212 HydrophobicContact CD1-CD2 4.2Å
148	E	85.3	Confident	68.9	Low	17 Å²	17	86.1 Å²	86.1	8%	0.079	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.7	175.7	-39.6	-167.2	114.1	0	0	110.5	V120 R121 R146 R150 Y210 S211	V120-E148 CarbonylContact O-C 3.59Å; V120-E148 WeakPolarHBondContact O-CA 3.37Å; R121-E148 HydrophobicContact CG-CG 4.32Å; R121-E148 WeakPolarHBondContact CG-OE1 3.37Å; R121-E148 IonicContact NE-OE1 3.67Å; R146-E148 HydrophobicContact CG-CG 3.91Å; R146-E148 IonicContact CZ-OE1 2.67Å; R146-E148 IonicContact CZ-OE2 3.49Å; R146-E148 IonicContact NE-OE1 3.93Å; R146-E148 PolarHBondContact NE-OE1 3.38Å; R146-E148 IonicContact NE-OE2 2.69Å; R146-E148 IonicContact NH2-OE1 2.8Å; R146-E148 PolarHBondContact NH2-OE1 2.92Å; R146-E148 IonicContact NH2-OE2 2.56Å; R146-E148 PolarHBondContact NH2-OE2 3.46Å; E148-R150 HydrophobicContact CB-CG 4.27Å; E148-R150 IonicContact OE2-CZ 3.11Å; E148-R150 IonicContact OE2-NE 3.51Å; E148-R150 PolarHBondContact OE2-NE 3.49Å; E148-R150 IonicContact OE2-NH2 3.84Å; E148-R150 PolarHBondContact OE2-NH2 2.9Å; E148-Y210 CarbonylContact O-C 3.54Å; E148-S211 PolarHBondContact N-O 3.28Å; E148-S211 PolarHBondContact O-N 2.9Å; E148-S211 PolarHBondContact O-OG 3.05Å
149	L	83.4	Confident	66.5	Low	0 Å²	0	88.3 Å²	88.3	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	106	165.8	176.3	56.7	0	0	0	107.9	V102 V107 V113 G119 V120 L122 P208 Y210	V102-L149 HydrophobicContact CG2-CD1 3.45Å; V102-L149 VanDerWaalsContact CG2-CD1 3.45Å; V107-L149 HydrophobicContact CG1-CD2 3.76Å; V113-L149 HydrophobicContact CG2-CD2 3.6Å; V113-L149 HydrophobicContact CG2-CG 4.31Å; G119-L149 CarbonylContact C-O 3.56Å; G119-L149 WeakPolarHBondContact CA-O 3.37Å; V120-L149 HydrophobicContact CB-CB 4.45Å; V120-L149 PolarHBondContact N-O 3.43Å; V120-L149 PolarHBondContact O-N 2.93Å; L122-L149 HydrophobicContact CD1-CB 4.14Å; L122-L149 HydrophobicContact CG-CB 4.47Å; L149-P208 HydrophobicContact CD1-CB 4.15Å; L149-Y210 HydrophobicContact CD1-CD1 4.35Å; L149-Y210 HydrophobicContact CD1-CE1 4.35Å
150	R	80.2	Confident	64.1	Low	85 Å²	85	88.1 Å²	88.1	32%	0.321	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	137	-176.5	-69.3	-178.4	-179.6	156.2	4.7	110.9	E99 E148 P208 N209 S211	E99-R150 IonicContact OE1-NH1 3.43Å; E99-R150 PolarHBondContact OE1-NH1 3Å; E148-R150 HydrophobicContact CB-CG 4.27Å; E148-R150 IonicContact OE2-CZ 3.11Å; E148-R150 IonicContact OE2-NE 3.51Å; E148-R150 PolarHBondContact OE2-NE 3.49Å; E148-R150 IonicContact OE2-NH2 3.84Å; E148-R150 PolarHBondContact OE2-NH2 2.9Å; R150-P208 CarbonylContact O-C 3.58Å; R150-P208 VanDerWaalsContact O-CA 3.26Å; R150-P208 WeakPolarHBondContact O-CA 3.46Å; R150-P208 WeakPolarHBondContact O-CB 3.27Å; R150-N209 PolarHBondContact N-O 2.84Å; R150-N209 PolarHBondContact O-N 2.95Å; R150-S211 VanDerWaalsContact CD-OG 3.29Å; R150-S211 WeakPolarHBondContact CD-OG 3.31Å; R150-S211 VanDerWaalsContact CZ-OG 3.24Å; R150-S211 PolarHBondContact NE-OG 3.3Å; R150-S211 VanDerWaalsContact NE-OG 3.08Å
151	N	70.9	Confident	61.5	Low	21 Å²	21	93.2 Å²	93.2	11%	0.112	49%	0.491	C	S	.	.			trans	-109.7	123.1	174.6	-161	0.5	0	0	0	110	V113 D114 Y153 P208	V113-N151 HydrophobicContact CG1-CB 3.92Å; D114-N151 PolarHBondContact OD1-ND2 3.03Å; N151-Y153 VanDerWaalsContact C-N 3.28Å; N151-Y153 PolarHBondContact O-N 3.15Å; N151-Y153 VanDerWaalsContact OD1-CD2 3.29Å; N151-Y153 WeakPolarHBondContact OD1-CD2 3.38Å; N151-P208 HydrophobicContact CB-CB 4.46Å
152	I	60.6	Low	58.9	Low	94 Å²	94	96 Å²	96	48%	0.482	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-73.1	-22.4	-168.9	-62.8	177.1	0	0	0	111.9	A154	I152-A154 PolarHBondContact O-N 3.14Å
153	Y	52.6	Low	56.6	Low	147 Å²	147	96.2 Å²	96.2	58%	0.576	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-62.9	-11.5	-179.7	-65	-71	0	0	0	115.6	N151 G155 D206	N151-Y153 VanDerWaalsContact C-N 3.28Å; N151-Y153 PolarHBondContact O-N 3.15Å; N151-Y153 VanDerWaalsContact OD1-CD2 3.29Å; N151-Y153 WeakPolarHBondContact OD1-CD2 3.38Å; Y153-G155 VanDerWaalsContact C-N 3.26Å; Y153-G155 PolarHBondContact O-N 3.08Å; Y153-D206 WeakPolarHBondContact CE2-O 3.41Å; Y153-D206 VanDerWaalsContact OH-CB 3.29Å; Y153-D206 WeakPolarHBondContact OH-CB 3.44Å; Y153-D206 PolarHBondContact OH-O 3.35Å
154	A	42.9	Very low	54.5	Low	63 Å²	63	97 Å²	97	52%	0.521	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-73.8	-7.5	-178.2	0	0	0	0	0	115.3	G117 I152	G117-A154 WeakPolarHBondContact O-CB 3.29Å; I152-A154 PolarHBondContact O-N 3.14Å
155	G	36.2	Very low	52.2	Low	73 Å²	73	96.3 Å²	96.3	75%	0.753	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-107.5	-11.1	-170.4	0	0	0	0	0	117.4	Y153	Y153-G155 VanDerWaalsContact C-N 3.26Å; Y153-G155 PolarHBondContact O-N 3.08Å
156	S	32.5	Very low	49.6	Very low	84 Å²	84	97.2 Å²	97.2	59%	0.587	56%	0.557	S	S	*	*			trans	-121.1	57.2	-158.3	50.4	0	0	0	0	115.2	P158	S156-P158 WeakPolarHBondContact O-CD 3.46Å
157	N	29.3	Very low	47.2	Very low	164 Å²	164	100.3 Å²	100.3	88%	0.877	58%	0.58	S	S	*	*			trans	-70.1	110	162.4	-89	-27.5	0	0	0	109.9	L159	N157-L159 VanDerWaalsContact C-N 3.25Å; N157-L159 PolarHBondContact O-N 3.1Å
158	P	30.7	Very low	44.6	Very low	127 Å²	127	104.3 Å²	104.3	83%	0.825	61%	0.608	S	S	*	*			trans	-89.1	36.2	-164.4	37.7	-36.2	0	0	0	113	S156	S156-P158 WeakPolarHBondContact O-CD 3.46Å
159	L	28.4	Very low	42.3	Very low	162 Å²	162	110.4 Å²	110.4	85%	0.848	64%	0.641	S	S	*	*			trans	-154.2	91.9	-171	-157.5	71.3	0	0	0	116.4	N157	N157-L159 VanDerWaalsContact C-N 3.25Å; N157-L159 PolarHBondContact O-N 3.1Å
160	S	32.6	Very low	40.3	Very low	122 Å²	122	115.5 Å²	115.5	85%	0.853	67%	0.668	S	S	*	*				-157.4	146.3	126.8	62.2	0	0	0	0	111.2
161	K	27	Very low	38	Very low	212 Å²	212	121.5 Å²	121.5	92%	0.922	69%	0.69	S	S	*	*			trans	-97.3	132.6	172.1	-69.3	172.7	175.2	174.1	0	109.2
162	S	32	Very low	36.1	Very low	111 Å²	111	125 Å²	125	78%	0.776	72%	0.722	S	S	*	*			trans	163	141.3	147.3	179.3	0	0	0	0	109.8
163	T	36.1	Very low	35.1	Very low	122 Å²	122	130.4 Å²	130.4	75%	0.748	75%	0.745	S	S	*	*			cis	-154	152.8	-25.8	-71.2	0	0	0	0	106.2
164	N	34.4	Very low	34	Very low	131 Å²	131	128.5 Å²	128.5	70%	0.701	76%	0.76	S	S	*	*			trans	-65.7	162.7	-179	-64.6	-24.8	0	0	0	113.3	T166	N164-T166 HydrophobicContact CB-CG2 3.92Å
165	P	37.2	Very low	33.6	Very low	121 Å²	121	128.4 Å²	128.4	79%	0.786	77%	0.765	S	S	*	*				-127	115.4	85.5	34.9	-26.9	0	0	0	112.6
166	T	33.2	Very low	33.5	Very low	93 Å²	93	133.4 Å²	133.4	57%	0.571	77%	0.774	S	S	*	*				40.2	99	86.6	57.2	0	0	0	0	115.5	N164	N164-T166 HydrophobicContact CB-CG2 3.92Å
167	N	38.4	Very low	33.7	Very low	156 Å²	156	133.5 Å²	133.5	83%	0.834	78%	0.78	S	S	*	*			trans	163.6	149.1	132.4	-82.1	-19.2	0	0	0	109.6
168	S	33	Very low	34.1	Very low	85 Å²	85	130.3 Å²	130.3	59%	0.594	78%	0.776	S	S	*	*			cis	-177.3	156.3	-19.1	54.6	0	0	0	0	108.5
169	L	37.8	Very low	34.1	Very low	146 Å²	146	136.1 Å²	136.1	76%	0.764	78%	0.781	S	S	*	*			trans	67.1	151.2	176.4	-74.7	62.5	0	0	0	114.2
170	N	39.9	Very low	34.3	Very low	107 Å²	107	131.8 Å²	131.8	57%	0.572	78%	0.776	S	S	*	*			cis	-140.9	134.1	-2.1	-105.3	-37.2	0	0	0	108.2
171	R	31.6	Very low	34.4	Very low	211 Å²	211	134 Å²	134	80%	0.796	78%	0.777	S	S	*	*				53.6	84.6	91.8	-172.4	-177.2	-76.2	119.2	-12.1	112.2
172	A	31.3	Very low	34.9	Very low	94 Å²	94	128.5 Å²	128.5	78%	0.777	76%	0.763	S	S	*	*				86.4	118.5	64.4	0	0	0	0	0	114.5
173	Q	39.2	Very low	34.9	Very low	207 Å²	207	130.7 Å²	130.7	97%	0.967	77%	0.766	S	S	*	*			trans	-152.4	104	160.7	-134.1	171.7	0.6	0	0	109.8
174	A	31	Very low	34.9	Very low	108 Å²	108	134 Å²	134	89%	0.893	77%	0.773	S	S	*	*			trans	-127.6	136.3	167.7	0	0	0	0	0	106.9
175	G	34.4	Very low	34.7	Very low	60 Å²	60	132.9 Å²	132.9	62%	0.619	78%	0.775	S	S	*	*			trans	-172.9	113.7	-175	0	0	0	0	0	114.7
176	L	34	Very low	34.5	Very low	179 Å²	179	132.3 Å²	132.3	94%	0.937	78%	0.775	S	S	*	*			trans	63.9	151.4	160.8	-58.9	104	0	0	0	116.9
177	A	35.5	Very low	34.7	Very low	86 Å²	86	134.6 Å²	134.6	71%	0.711	78%	0.782	S	S	*	*			cis	-160.5	156	-27.9	0	0	0	0	0	110.7
178	A	37.9	Very low	34.5	Very low	97 Å²	97	135.1 Å²	135.1	80%	0.802	78%	0.779	S	S	*	*			trans	91.3	156.7	142.4	0	0	0	0	0	120.2
179	R	31.4	Very low	34.4	Very low	248 Å²	248	136.3 Å²	136.3	94%	0.936	79%	0.788	S	S	*	*			cis	-178.5	125.1	-31.5	-174	176.4	-165.8	171.3	2.8	108.2
180	G	32.8	Very low	34.3	Very low	71 Å²	71	137.7 Å²	137.7	73%	0.732	79%	0.794	S	S	*	*			trans	89.7	157.9	177.1	0	0	0	0	0	114.2
181	L	34.9	Very low	33.8	Very low	169 Å²	169	144 Å²	144	89%	0.885	81%	0.81	S	S	*	*			cis	-152.7	143.9	-2.7	-157.9	76.1	0	0	0	110.1
182	P	36.5	Very low	33.9	Very low	97 Å²	97	139.3 Å²	139.3	63%	0.63	81%	0.81	S	S	*	*			trans	-102.1	179.4	176.2	39.5	-35.4	0	0	0	113.8
183	N	32.4	Very low	34	Very low	157 Å²	157	142.6 Å²	142.6	84%	0.84	81%	0.808	S	S	*	*			trans	78.7	141.6	-178.4	-49.5	-15.7	0	0	0	112.3
184	E	36.4	Very low	33.9	Very low	191 Å²	191	139.9 Å²	139.9	89%	0.893	80%	0.801	S	S	*	*			cis	-138.4	170	47.5	-116.3	176.8	119.2	0	0	115.8
185	S	31	Very low	33.9	Very low	107 Å²	107	146.2 Å²	146.2	75%	0.748	80%	0.802	S	S	*	*			trans	-135.8	131.2	-179.6	60	0	0	0	0	111.7
186	S	33	Very low	33.6	Very low	110 Å²	110	148 Å²	148	77%	0.769	81%	0.81	S	S	*	*			trans	-171.9	172.6	161	50.5	0	0	0	0	114.6
187	I	36.8	Very low	33.6	Very low	140 Å²	140	149.1 Å²	149.1	72%	0.718	81%	0.807	S	S	*	*			trans	78.6	76.3	162.1	-40.8	-168.5	0	0	0	119
188	Q	35.1	Very low	33.4	Very low	167 Å²	167	151.8 Å²	151.8	78%	0.78	82%	0.815	S	S	*	*				53.5	102.5	114.6	-64.5	172.2	-14.2	0	0	121.1
189	S	29.3	Very low	33	Very low	111 Å²	111	154.4 Å²	154.4	78%	0.776	82%	0.815	S	S	*	*				17.8	119	128.4	60.9	0	0	0	0	120.8
190	I	37.1	Very low	32.9	Very low	174 Å²	174	150.9 Å²	150.9	89%	0.892	81%	0.807	S	S	*	*			trans	-123.4	146.9	139.1	-67	-176.4	0	0	0	108.5
191	R	28	Very low	32.9	Very low	239 Å²	239	153.5 Å²	153.5	90%	0.902	81%	0.808	S	S	*	*			trans	-115.8	109.6	-164.8	-175.9	-165.8	-148.3	161.4	5.8	110.7
192	S	34.9	Very low	33.1	Very low	114 Å²	114	151.2 Å²	151.2	80%	0.797	80%	0.801	S	S	*	*			trans	-143.9	149.1	167.9	63	0	0	0	0	112.7
193	H	32.9	Very low	33.1	Very low	162 Å²	162	151.8 Å²	151.8	75%	0.75	80%	0.804	S	S	*	*			trans	-80.2	141.4	-173	-61.4	-123.9	0	0	0	110.9
194	N	36.6	Very low	33.4	Very low	151 Å²	151	152.2 Å²	152.2	81%	0.807	81%	0.807	S	S	*	*				172.8	156.6	100.5	-93.3	-60.1	0	0	0	115.6
195	R	31.7	Very low	34.2	Very low	241 Å²	241	146 Å²	146	91%	0.909	79%	0.793	S	S	*	*			trans	48.1	101.5	158.1	-94.7	-179.5	171.2	133.7	0.4	119.6	K197	R195-K197 PolarHBondContact O-N 3.41Å
196	A	28.3	Very low	35.5	Very low	97 Å²	97	146.1 Å²	146.1	80%	0.802	79%	0.786	S	S	*	*			trans	-37	124.8	157.2	0	0	0	0	0	115.7
197	K	32.7	Very low	37.1	Very low	202 Å²	202	142.2 Å²	142.2	88%	0.878	76%	0.763	S	S	*	*			trans	-132.1	109.6	137.3	-89.5	-174.3	174.3	-179.6	0	107.5	R195 L199	R195-K197 PolarHBondContact O-N 3.41Å; K197-L199 VanDerWaalsContact C-N 3.29Å; K197-L199 PolarHBondContact O-N 3.27Å
198	T	31.1	Very low	38.9	Very low	142 Å²	142	136 Å²	136	87%	0.871	73%	0.732	S	S	*	*			trans	-74.5	83.2	174.5	43.4	0	0	0	0	109.6	K200	T198-K200 PolarHBondContact O-N 2.89Å; T198-K200 VanDerWaalsContact O-N 3.15Å
199	L	30.6	Very low	41.1	Very low	152 Å²	152	129.9 Å²	129.9	80%	0.796	70%	0.704	S	S	*	*			trans	-68.3	106.3	169.9	-161.6	78.7	0	0	0	107.9	K197 V201	K197-L199 VanDerWaalsContact C-N 3.29Å; K197-L199 PolarHBondContact O-N 3.27Å; L199-V201 PolarHBondContact O-N 2.93Å
200	K	28.7	Very low	43.8	Very low	175 Å²	175	125.2 Å²	125.2	76%	0.761	67%	0.67	S	S	*	*			trans	-61.7	103.7	167.7	-96	-173.2	174	-177.2	0	107.4	T198 V202	T198-K200 PolarHBondContact O-N 2.89Å; T198-K200 VanDerWaalsContact O-N 3.15Å; K200-V202 PolarHBondContact O-N 3.29Å
201	V	33.3	Very low	46.2	Very low	126 Å²	126	117.1 Å²	117.1	76%	0.764	63%	0.629	S	S	*	*			trans	-71.6	112.5	162.6	179.4	0	0	0	0	106.4	L199	L199-V201 PolarHBondContact O-N 2.93Å
202	V	39.8	Very low	49.1	Very low	120 Å²	120	105.9 Å²	105.9	73%	0.727	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-73.7	128.7	170.8	179	0	0	0	0	107.1	K200	K200-V202 PolarHBondContact O-N 3.29Å
203	P	36.5	Very low	51.6	Low	109 Å²	109	102.6 Å²	102.6	71%	0.708	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-69.8	158.1	177.3	30.5	-35.1	0	0	0	111.4
204	D	38.8	Very low	54.3	Low	167 Å²	167	95 Å²	95	89%	0.893	52%	0.524	S	S	*	.	S	Bend	trans	-57.6	145.2	-179.4	-67.1	-72.5	0	0	0	113.8
205	G	53	Low	56.8	Low	59 Å²	59	89.1 Å²	89.1	61%	0.608	50%	0.495	S	S	*	.	S	Bend	trans	110.2	-73.4	159	0	0	0	0	0	115.9	G207	G205-G207 PolarHBondContact O-N 3.3Å; G205-G207 VanDerWaalsContact O-N 3.12Å
206	D	57.4	Low	59.6	Low	111 Å²	111	77.9 Å²	77.9	59%	0.594	45%	0.452	S	S	*	.			trans	-94.4	39.7	-151	-56.7	-38.1	0	0	0	115.4	Y153	Y153-D206 WeakPolarHBondContact CE2-O 3.41Å; Y153-D206 VanDerWaalsContact OH-CB 3.29Å; Y153-D206 WeakPolarHBondContact OH-CB 3.44Å; Y153-D206 PolarHBondContact OH-O 3.35Å
207	G	65.8	Low	62.6	Low	28 Å²	28	74.2 Å²	74.2	29%	0.289	42%	0.42	S	S	.	.	S	Bend	trans	-89.4	160.6	173.1	0	0	0	0	0	113.3	G205	G205-G207 PolarHBondContact O-N 3.3Å; G205-G207 VanDerWaalsContact O-N 3.12Å
208	P	74.9	Confident	65.3	Low	10 Å²	10	64.6 Å²	64.6	7%	0.065	38%	0.378	C	S	.	.			trans	-66.4	144.2	166	29.3	-33.1	0	0	0	110.1	V102 T108 L149 R150 N151	V102-P208 HydrophobicContact CB-CG 4.41Å; V102-P208 WeakPolarHBondContact CB-O 3.47Å; V102-P208 HydrophobicContact CG2-CB 4.47Å; V102-P208 HydrophobicContact CG2-CG 4.23Å; V102-P208 WeakPolarHBondContact CG2-O 3.48Å; V102-P208 PolarHBondContact N-O 2.95Å; T108-P208 HydrophobicContact CG2-CG 3.85Å; L149-P208 HydrophobicContact CD1-CB 4.15Å; R150-P208 CarbonylContact O-C 3.58Å; R150-P208 VanDerWaalsContact O-CA 3.26Å; R150-P208 WeakPolarHBondContact O-CA 3.46Å; R150-P208 WeakPolarHBondContact O-CB 3.27Å; N151-P208 HydrophobicContact CB-CB 4.46Å
209	N	82.4	Confident	68.2	Low	38 Å²	38	59.8 Å²	59.8	20%	0.203	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.7	-177.7	-72.8	-21.8	0	0	0	110.3	W100 P101 R150	W100-N209 WeakPolarHBondContact O-CA 3.48Å; P101-N209 VanDerWaalsContact CA-OD1 3.3Å; P101-N209 WeakPolarHBondContact CA-OD1 3.43Å; R150-N209 PolarHBondContact N-O 2.84Å; R150-N209 PolarHBondContact O-N 2.95Å
210	Y	85.7	Confident	70.8	Confident	12 Å²	12	52.8 Å²	52.8	5%	0.047	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	137.7	159.2	-63.9	-79.5	0	0	0	108.7	L53 E99 W100 V102 L122 E148 L149	L53-Y210 HydrophobicContact CD2-CE1 3.83Å; L53-Y210 WeakPolarHBondContact CD2-OH 3.35Å; E99-Y210 CarbonylContact C-O 3.55Å; E99-Y210 VanDerWaalsContact CA-O 3.28Å; E99-Y210 WeakPolarHBondContact CA-O 3.35Å; W100-Y210 AromaticContact CD1-CD2 3.65Å; W100-Y210 VanDerWaalsContact CE2-CB 3.42Å; W100-Y210 AromaticContact CE2-CD2 3.84Å; W100-Y210 AromaticContact CE2-CG 3.8Å; W100-Y210 HydrophobicContact CG-CD2 4.48Å; W100-Y210 HydrophobicContact CZ2-CD2 4.37Å; W100-Y210 AromaticContact CZ2-CG 3.97Å; W100-Y210 HydrophobicContact CZ2-CG 3.97Å; W100-Y210 PolarHBondContact N-O 3.41Å; W100-Y210 AromaticContact NE1-CD2 3.19Å; W100-Y210 AromaticContact NE1-CE2 3.94Å; W100-Y210 AromaticContact NE1-CG 3.66Å; W100-Y210 PolarHBondContact O-N 3.27Å; V102-Y210 HydrophobicContact CB-CE2 4.08Å; V102-Y210 HydrophobicContact CG1-CE2 4.26Å; V102-Y210 HydrophobicContact CG2-CD2 3.69Å; V102-Y210 HydrophobicContact CG2-CE2 3.49Å; V102-Y210 VanDerWaalsContact CG2-CE2 3.49Å; V102-Y210 HydrophobicContact CG2-CG 4.39Å; L122-Y210 HydrophobicContact CD1-CD1 4.12Å; L122-Y210 HydrophobicContact CD1-CE1 3.91Å; E148-Y210 CarbonylContact O-C 3.54Å; L149-Y210 HydrophobicContact CD1-CD1 4.35Å; L149-Y210 HydrophobicContact CD1-CE1 4.35Å
211	S	86.9	Confident	73.5	Confident	5 Å²	5	47 Å²	47	4%	0.035	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119	172	59.9	0	0	0	0	108.8	A98 E148 R150	A98-S211 CarbonylContact O-C 3.45Å; A98-S211 WeakPolarHBondContact O-CA 3.37Å; E148-S211 PolarHBondContact N-O 3.28Å; E148-S211 PolarHBondContact O-N 2.9Å; E148-S211 PolarHBondContact O-OG 3.05Å; R150-S211 VanDerWaalsContact CD-OG 3.29Å; R150-S211 WeakPolarHBondContact CD-OG 3.31Å; R150-S211 VanDerWaalsContact CZ-OG 3.24Å; R150-S211 PolarHBondContact NE-OG 3.3Å; R150-S211 VanDerWaalsContact NE-OG 3.08Å
212	F	88.6	Confident	75.9	Confident	3 Å²	3	41.8 Å²	41.8	1%	0.013	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.2	178.1	177.7	-109.4	0	0	0	109.2	F97 A98 W100 V124 H129 Q145 R146 L147 E214	F97-F212 CarbonylContact C-O 3.49Å; F97-F212 WeakPolarHBondContact CA-O 3.45Å; A98-F212 HydrophobicContact CB-CB 4.36Å; A98-F212 PolarHBondContact N-O 3.49Å; A98-F212 PolarHBondContact O-N 3.42Å; W100-F212 HydrophobicContact CH2-CB 3.92Å; W100-F212 HydrophobicContact CZ3-CB 3.67Å; V124-F212 HydrophobicContact CG1-CE2 3.91Å; H129-F212 HydrophobicContact CB-CD2 4.23Å; H129-F212 HydrophobicContact CB-CE2 4.4Å; H129-F212 HydrophobicContact CB-CG 4.48Å; H129-F212 AromaticContact CE1-CZ 3.94Å; H129-F212 AromaticContact ND1-CE1 3.95Å; H129-F212 AromaticContact ND1-CE2 3.84Å; H129-F212 AromaticContact ND1-CZ 3.57Å; Q145-F212 HydrophobicContact CB-CE2 4.3Å; Q145-F212 HydrophobicContact CG-CE2 4.42Å; Q145-F212 HydrophobicContact CG-CZ 4.17Å; R146-F212 WeakPolarHBondContact O-CA 3.48Å; L147-F212 HydrophobicContact CB-CD2 4.29Å; L147-F212 HydrophobicContact CD1-CB 3.91Å; L147-F212 HydrophobicContact CD1-CD2 4.2Å; F212-E214 HydrophobicContact CE1-CB 3.7Å; F212-E214 HydrophobicContact CZ-CB 3.92Å
213	M	88.8	Confident	77.6	Confident	44 Å²	44	41.8 Å²	41.8	22%	0.217	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.7	178.4	-174.8	-171	-48.5	0	0	109	T95 L96 F97 Q145 R146	T95-M213 HydrophobicContact CG2-CG 3.62Å; T95-M213 HydrophobicContact CG2-SD 4.31Å; L96-M213 CarbonylContact O-C 3.54Å; L96-M213 VanDerWaalsContact O-CA 3.3Å; L96-M213 WeakPolarHBondContact O-CA 3.45Å; F97-M213 HydrophobicContact CD1-CB 4.3Å; F97-M213 HydrophobicContact CD1-CE 4.04Å; F97-M213 HydrophobicContact CD1-CG 3.8Å; F97-M213 HydrophobicContact CD1-SD 4.4Å; F97-M213 HydrophobicContact CE1-CE 3.72Å; F97-M213 HydrophobicContact CE1-CG 3.7Å; F97-M213 HydrophobicContact CE1-SD 3.83Å; F97-M213 HydrophobicContact CZ-CG 4.47Å; Q145-M213 CarbonylContact C-O 3.57Å; Q145-M213 VanDerWaalsContact CA-O 3.31Å; Q145-M213 WeakPolarHBondContact CA-O 3.39Å; R146-M213 HydrophobicContact CB-CB 4.38Å; R146-M213 PolarHBondContact N-O 2.97Å; R146-M213 PolarHBondContact O-N 3.24Å
214	E	88.8	Confident	79	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	115.7	179.4	-179.1	174.3	-146.7	0	0	111.1	T95 L96 R142 H144 Q145 F212 I216	T95-E214 WeakPolarHBondContact CA-O 3.39Å; L96-E214 PolarHBondContact N-O 3.14Å; L96-E214 PolarHBondContact O-N 2.91Å; R142-E214 VanDerWaalsContact CD-OE1 3.23Å; R142-E214 WeakPolarHBondContact CD-OE1 3.44Å; R142-E214 IonicContact CZ-OE1 2.57Å; R142-E214 IonicContact NE-OE1 3.17Å; R142-E214 PolarHBondContact NE-OE1 2.8Å; R142-E214 IonicContact NH2-OE1 2.64Å; H144-E214 CarbonylContact O-C 3.56Å; H144-E214 WeakPolarHBondContact O-CA 3.2Å; Q145-E214 HydrophobicContact CG-CB 4.26Å; Q145-E214 HydrophobicContact CG-CG 3.86Å; Q145-E214 PolarHBondContact NE2-OE1 3.2Å; F212-E214 HydrophobicContact CE1-CB 3.7Å; F212-E214 HydrophobicContact CZ-CB 3.92Å; E214-I216 HydrophobicContact CG-CD1 3.95Å; E214-I216 HydrophobicContact CG-CG1 3.72Å
215	S	89.4	Confident	80	Confident	28 Å²	28	32.9 Å²	32.9	20%	0.196	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121	175.3	-59.6	0	0	0	0	110.9	L94 T95 F143 H144	L94-S215 WeakPolarHBondContact O-CA 3.4Å; T95-S215 WeakPolarHBondContact CG2-OG 3.44Å; T95-S215 PolarHBondContact OG1-OG 3.34Å; F143-S215 PolarHBondContact N-O 3.47Å; H144-S215 PolarHBondContact O-N 2.87Å
216	I	90.5	Very high	80	Confident	5 Å²	5	39.1 Å²	39.1	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136.5	-174.9	-43.7	-178	0	0	0	109.4	L94 L96 I134 H140 D141 R142 E214 V218	L94-I216 PolarHBondContact N-O 3.11Å; L94-I216 PolarHBondContact O-N 2.96Å; L94-I216 VanDerWaalsContact O-O 3.14Å; L96-I216 HydrophobicContact CD1-CD1 3.8Å; I134-I216 HydrophobicContact CD1-CD1 4.16Å; I134-I216 HydrophobicContact CD1-CG2 4.48Å; H140-I216 HydrophobicContact CB-CG2 4.38Å; D141-I216 WeakPolarHBondContact O-CA 3.44Å; R142-I216 HydrophobicContact CG-CG1 4.36Å; E214-I216 HydrophobicContact CG-CD1 3.95Å; E214-I216 HydrophobicContact CG-CG1 3.72Å; I216-V218 HydrophobicContact CG2-CG1 4.26Å
217	V	90.7	Very high	79.9	Confident	20 Å²	20	40.5 Å²	40.5	12%	0.121	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.3	162	-176.5	0	0	0	0	108.5	R91 A92 H140 D141 F143	R91-V217 HydrophobicContact CG-CG1 3.75Å; A92-V217 WeakPolarHBondContact O-CA 3.46Å; H140-V217 WeakPolarHBondContact CA-O 3.32Å; D141-V217 PolarHBondContact N-O 2.94Å; D141-V217 PolarHBondContact O-N 3.21Å; F143-V217 HydrophobicContact CD2-CB 4.47Å; F143-V217 HydrophobicContact CD2-CG2 3.9Å; F143-V217 HydrophobicContact CE2-CB 3.81Å; F143-V217 HydrophobicContact CE2-CG2 3.47Å; F143-V217 VanDerWaalsContact CE2-CG2 3.47Å; F143-V217 HydrophobicContact CZ-CG2 4.32Å
218	V	90.3	Very high	79.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.9	-179.6	-104.6	0	0	0	0	111.8	R91 A92 L94 I134 A137 H140 I216 V220	R91-V218 CarbonylContact C-O 3.52Å; R91-V218 WeakPolarHBondContact CA-O 3.25Å; A92-V218 PolarHBondContact N-O 3.47Å; A92-V218 PolarHBondContact O-N 3.37Å; L94-V218 HydrophobicContact CD1-CG2 3.65Å; L94-V218 HydrophobicContact CG-CG2 4.14Å; I134-V218 HydrophobicContact CB-CG1 4.17Å; I134-V218 HydrophobicContact CD1-CB 4.35Å; I134-V218 HydrophobicContact CD1-CG1 3.6Å; I134-V218 HydrophobicContact CD1-CG2 3.84Å; I134-V218 HydrophobicContact CG1-CG1 4.42Å; I134-V218 HydrophobicContact CG2-CG1 4.11Å; A137-V218 HydrophobicContact CB-CG1 3.83Å; H140-V218 HydrophobicContact CB-CG1 3.57Å; I216-V218 HydrophobicContact CG2-CG1 4.26Å; V218-V220 HydrophobicContact CB-CG2 4.25Å
219	E	90.4	Very high	77.8	Confident	41 Å²	41	54.9 Å²	54.9	19%	0.192	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	110.1	173.3	-66.6	178.9	175.5	0	0	108.4	V89 C90 R91 A137 F138 R139	V89-E219 HydrophobicContact CG1-CB 3.75Å; V89-E219 HydrophobicContact CG1-CG 4.49Å; C90-E219 CarbonylContact O-C 3.51Å; C90-E219 WeakPolarHBondContact O-CA 3.34Å; R91-E219 HydrophobicContact CB-CG 4.23Å; R91-E219 HydrophobicContact CG-CG 4.1Å; A137-E219 CarbonylContact C-O 3.44Å; A137-E219 WeakPolarHBondContact CA-O 3.44Å; F138-E219 PolarHBondContact N-O 3.47Å; R139-E219 HydrophobicContact CB-CB 4.08Å; R139-E219 HydrophobicContact CB-CG 4.33Å; R139-E219 WeakPolarHBondContact CB-OE2 3.46Å; R139-E219 PolarHBondContact N-O 3.29Å; R139-E219 PolarHBondContact O-N 3.2Å
220	V	87.1	Confident	76.4	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.03	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.1	-172.8	177.3	0	0	0	0	110.1	V89 C90 A137 V218 C222 P237 V238	V89-V220 WeakPolarHBondContact CA-O 3.31Å; C90-V220 PolarHBondContact N-O 3.38Å; C90-V220 PolarHBondContact O-N 3.29Å; A137-V220 HydrophobicContact CB-CG2 4.29Å; V218-V220 HydrophobicContact CB-CG2 4.25Å; V220-C222 PolarHBondContact O-N 2.89Å; V220-P237 WeakPolarHBondContact CG1-O 3.39Å; V220-V238 HydrophobicContact CG2-CG1 4.45Å; V220-V238 HydrophobicContact CG2-CG2 4.19Å
221	P	85.5	Confident	74.9	Confident	53 Å²	53	57.3 Å²	57.3	34%	0.344	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	128.1	177.1	28.3	-33.9	0	0	0	110.7	G136	G136-P221 WeakPolarHBondContact O-CD 3.31Å
222	C	82.6	Confident	73.4	Confident	17 Å²	17	57.4 Å²	57.4	12%	0.115	28%	0.278	C	S	.	.			trans	-84	137.9	177.8	-61.1	0	0	0	0	111.2	L88 C90 V220 E224 I234 C236	L88-C222 HydrophobicContact CB-CB 3.98Å; L88-C222 PolarHBondContact O-N 3.49Å; C90-C222 PolarHBondContact N-SG 2.93Å; V220-C222 PolarHBondContact O-N 2.89Å; C222-E224 PolarHBondContact O-N 3.15Å; C222-I234 HydrophobicContact CB-CG2 3.61Å; C222-C236 HydrophobicContact CB-CB 4Å; C222-C236 WeakPolarHBondContact CB-SG 3.27Å; C222-C236 WeakPolarHBondContact SG-CB 3.43Å; C222-C236 CovalentContact SG-SG 2.04Å; C222-C236 PolarHBondContact SG-SG 3.08Å
223	Q	75.2	Confident	72.3	Confident	120 Å²	120	57.7 Å²	57.7	56%	0.561	28%	0.281	S	S	*	.	B	Isolated β-bridge	trans	-87.1	106.5	173.4	-175.8	168.8	-39.7	0	0	110.2	V235	Q223-V235 PolarHBondContact N-O 3.43Å
224	E	65.2	Low	71.6	Confident	43 Å²	43	56 Å²	56	20%	0.201	27%	0.272	C	S	.	.			trans	-62	145.6	163.7	-66.7	178.9	142.9	0	0	110.6	L88 C222 K226 K359	L88-E224 HydrophobicContact CD1-CG 3.93Å; C222-E224 PolarHBondContact O-N 3.15Å; E224-K226 PolarHBondContact O-N 3.36Å; E224-K226 VanDerWaalsContact O-N 3.08Å; E224-K359 WeakPolarHBondContact OE2-CD 3.39Å; E224-K359 IonicContact OE2-NZ 3.88Å; E224-K359 PolarHBondContact OE2-NZ 2.98Å
225	P	60.5	Low	71	Confident	47 Å²	47	56.9 Å²	56.9	31%	0.305	28%	0.278	S	S	.	.			trans	-61.8	114.1	172.5	25	-32.5	0	0	0	110.2	K227 H230	P225-K227 PolarHBondContact O-N 3.48Å; P225-H230 HydrophobicContact CB-CB 4.23Å
226	K	54	Low	70.7	Confident	190 Å²	190	55.6 Å²	55.6	83%	0.826	27%	0.269	S	S	*	.	S	Bend	trans	-63.2	-6.7	-178.4	-68.2	-176.7	178.1	177.9	0	114.8	E224	E224-K226 PolarHBondContact O-N 3.36Å; E224-K226 VanDerWaalsContact O-N 3.08Å
227	K	54.3	Low	70.4	Confident	139 Å²	139	56.4 Å²	56.4	60%	0.604	28%	0.275	S	S	*	.	S	Bend	trans	-111.9	128.7	178.4	-68.5	177.8	177.5	178.8	0	109.4	P225 H229	P225-K227 PolarHBondContact O-N 3.48Å; K227-H229 PolarHBondContact O-N 3.18Å
228	F	51.1	Low	70.1	Confident	199 Å²	199	55.5 Å²	55.5	87%	0.873	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-7.8	178.4	-71.2	-84.6	0	0	0	115.5	H230	F228-H230 VanDerWaalsContact C-N 3.34Å
229	H	46.8	Very low	69.8	Low	142 Å²	142	58.6 Å²	58.6	66%	0.657	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	13.8	-174.6	-58.1	-63.9	0	0	0	114	K227 Q656	K227-H229 PolarHBondContact O-N 3.18Å; H229-Q656 PolarHBondContact O-OE1 3.02Å
230	H	51.4	Low	69.4	Low	87 Å²	87	56.9 Å²	56.9	40%	0.403	27%	0.273	S	S	.	.			trans	-134.7	112.9	-179.5	-42.1	-52.1	0	0	0	110.6	P225 F228 G232	P225-H230 HydrophobicContact CB-CB 4.23Å; F228-H230 VanDerWaalsContact C-N 3.34Å; H230-G232 PolarHBondContact O-N 3.2Å
231	I	55.8	Low	69	Low	14 Å²	14	58.6 Å²	58.6	7%	0.072	28%	0.28	C	S	.	.			trans	-70.7	52.6	150.4	-62.6	165.4	0	0	0	107.7	Q300 I304 F363 I653 Q656	I231-Q300 HydrophobicContact CG2-CB 3.88Å; I231-I304 HydrophobicContact CD1-CD1 4.37Å; I231-I304 HydrophobicContact CG1-CD1 4.4Å; I231-I304 HydrophobicContact CG2-CD1 3.38Å; I231-F363 HydrophobicContact CD1-CD1 3.94Å; I231-F363 HydrophobicContact CD1-CE1 3.62Å; I231-F363 HydrophobicContact CD1-CE2 4.34Å; I231-F363 HydrophobicContact CD1-CG 4.42Å; I231-F363 HydrophobicContact CD1-CZ 3.84Å; I231-I653 HydrophobicContact CD1-CG1 4.32Å; I231-Q656 HydrophobicContact CB-CB 4.07Å; I231-Q656 HydrophobicContact CD1-CB 4.34Å; I231-Q656 HydrophobicContact CG1-CB 4.32Å
232	G	54.8	Low	68.5	Low	7 Å²	7	57 Å²	57	7%	0.072	27%	0.268	C	S	.	.			trans	-75.9	148.8	-173.9	0	0	0	0	0	110.6	H230 I234 Q300	H230-G232 PolarHBondContact O-N 3.2Å; G232-I234 PolarHBondContact O-N 3.37Å; G232-Q300 PolarHBondContact O-NE2 3.45Å; G232-Q300 VanDerWaalsContact O-NE2 3.07Å; G232-Q300 PolarHBondContact O-OE1 3.15Å
233	A	64.7	Low	68	Low	9 Å²	9	60.8 Å²	60.8	7%	0.074	28%	0.284	C	S	.	.			trans	-52.1	137.2	173.2	0	0	0	0	0	110.7	V235 C297 F298 P660	A233-V235 PolarHBondContact O-N 3.36Å; A233-V235 VanDerWaalsContact O-N 3.16Å; A233-C297 HydrophobicContact CB-CB 4.24Å; A233-F298 CarbonylContact C-O 3.56Å; A233-F298 VanDerWaalsContact CA-O 3.27Å; A233-F298 WeakPolarHBondContact CA-O 3.15Å; A233-P660 HydrophobicContact CB-CG 4.46Å
234	I	73.8	Confident	67.4	Low	7 Å²	7	56.5 Å²	56.5	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	114.4	172.7	-54.3	171.3	0	0	0	106.3	L81 L88 C222 G232 C297 F298 Q300	L81-I234 HydrophobicContact CD2-CD1 3.78Å; L88-I234 HydrophobicContact CD1-CD1 4.21Å; L88-I234 HydrophobicContact CD1-CG2 4.43Å; C222-I234 HydrophobicContact CB-CG2 3.61Å; G232-I234 PolarHBondContact O-N 3.37Å; I234-C297 WeakPolarHBondContact O-CA 3.19Å; I234-F298 HydrophobicContact CB-CB 4.22Å; I234-F298 HydrophobicContact CB-CD2 4.37Å; I234-F298 PolarHBondContact N-O 2.77Å; I234-F298 PolarHBondContact O-N 3.18Å; I234-Q300 HydrophobicContact CD1-CG 4.46Å; I234-Q300 HydrophobicContact CG1-CG 4.05Å; I234-Q300 VanDerWaalsContact CG1-NE2 3.31Å
235	V	77.8	Confident	67	Low	22 Å²	22	63 Å²	63	13%	0.133	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.9	179.6	-172.2	0	0	0	0	109	Q223 A233 N295 I296 P660	Q223-V235 PolarHBondContact N-O 3.43Å; A233-V235 PolarHBondContact O-N 3.36Å; A233-V235 VanDerWaalsContact O-N 3.16Å; V235-N295 HydrophobicContact CG1-CB 4.18Å; V235-I296 WeakPolarHBondContact CA-O 3.31Å; V235-P660 HydrophobicContact CG2-CG 4.24Å
236	C	82.9	Confident	66.7	Low	0 Å²	0	66.1 Å²	66.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	94.9	176.2	-42.6	0	0	0	0	107.8	C90 C222 I296	C90-C236 HydrophobicContact CB-CB 3.59Å; C222-C236 HydrophobicContact CB-CB 4Å; C222-C236 WeakPolarHBondContact CB-SG 3.27Å; C222-C236 WeakPolarHBondContact SG-CB 3.43Å; C222-C236 CovalentContact SG-SG 2.04Å; C222-C236 PolarHBondContact SG-SG 3.08Å; C236-I296 HydrophobicContact CB-CB 4.29Å; C236-I296 PolarHBondContact N-O 2.93Å; C236-I296 PolarHBondContact O-N 2.87Å
237	P	83.6	Confident	66.5	Low	23 Å²	23	67.6 Å²	67.6	15%	0.149	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	114.7	-169.6	33.6	-33.6	0	0	0	111.5	V220 W239 I294	V220-P237 WeakPolarHBondContact CG1-O 3.39Å; P237-W239 HydrophobicContact CB-CZ2 3.72Å; P237-W239 HydrophobicContact CG-CZ2 4.43Å; P237-I294 WeakPolarHBondContact CA-O 3.38Å
238	V	85.1	Confident	66.5	Low	1 Å²	1	66.7 Å²	66.7	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	113.5	178.1	-169.3	0	0	0	0	109.1	L94 I134 V220 G293 I294 I296	L94-V238 HydrophobicContact CD1-CG1 4.05Å; I134-V238 HydrophobicContact CG2-CG1 3.58Å; V220-V238 HydrophobicContact CG2-CG1 4.45Å; V220-V238 HydrophobicContact CG2-CG2 4.19Å; V238-G293 WeakPolarHBondContact O-CA 3.38Å; V238-I294 HydrophobicContact CB-CB 4.34Å; V238-I294 PolarHBondContact N-O 3.48Å; V238-I294 PolarHBondContact O-N 3.42Å; V238-I296 HydrophobicContact CG2-CD1 3.76Å; V238-I296 HydrophobicContact CG2-CG1 4.48Å
239	W	83.2	Confident	66.8	Low	64 Å²	64	60.4 Å²	60.4	24%	0.242	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	105.5	-177.6	-56.9	103.7	0	0	0	111.7	I134 K135 P237 R278 L292 G293	I134-W239 CarbonylContact C-O 3.56Å; I134-W239 VanDerWaalsContact CA-O 3.31Å; I134-W239 WeakPolarHBondContact CA-O 3.39Å; K135-W239 HydrophobicContact CB-CB 4.17Å; K135-W239 PolarHBondContact N-O 2.96Å; P237-W239 HydrophobicContact CB-CZ2 3.72Å; P237-W239 HydrophobicContact CG-CZ2 4.43Å; W239-R278 HydrophobicContact CZ3-CB 3.86Å; W239-R278 HydrophobicContact CZ3-CG 4.35Å; W239-L292 CarbonylContact C-O 3.53Å; W239-L292 VanDerWaalsContact CA-O 3.27Å; W239-L292 WeakPolarHBondContact CA-O 3.24Å; W239-G293 VanDerWaalsContact CE3-CA 3.42Å
240	I	82	Confident	67.5	Low	6 Å²	6	54.7 Å²	54.7	3%	0.031	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	122.3	175.4	-50.1	-176.9	0	0	0	108.4	V74 L96 L132 I134 L292 I294	V74-I240 HydrophobicContact CG2-CD1 4.32Å; L96-I240 HydrophobicContact CD1-CD1 4.45Å; L96-I240 HydrophobicContact CD2-CD1 3.65Å; L132-I240 HydrophobicContact CB-CG2 4.16Å; L132-I240 HydrophobicContact CD1-CG2 4.48Å; L132-I240 HydrophobicContact CD2-CG2 4.26Å; I134-I240 HydrophobicContact CG1-CG1 4.39Å; I240-L292 HydrophobicContact CB-CB 4.31Å; I240-L292 HydrophobicContact CB-CD2 4.38Å; I240-L292 HydrophobicContact CD1-CD2 3.89Å; I240-L292 HydrophobicContact CG1-CD2 4.2Å; I240-L292 PolarHBondContact N-O 3.12Å; I240-L292 PolarHBondContact O-N 2.97Å; I240-I294 HydrophobicContact CD1-CD1 4.4Å
241	K	78.5	Confident	68.1	Low	41 Å²	41	53.8 Å²	53.8	18%	0.178	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.3	171	-160.2	-155.1	159.8	173.5	0	109.4	V133 D289	V133-K241 PolarHBondContact N-O 2.76Å; V133-K241 PolarHBondContact O-N 3.48Å; K241-D289 WeakPolarHBondContact CE-OD1 3.33Å; K241-D289 WeakPolarHBondContact CE-OD2 3.4Å; K241-D289 IonicContact NZ-OD1 2.78Å; K241-D289 PolarHBondContact NZ-OD1 2.99Å; K241-D289 IonicContact NZ-OD2 3.58Å; K241-D289 PolarHBondContact NZ-OD2 3.48Å
242	Q	75.3	Confident	68.6	Low	19 Å²	19	53.6 Å²	53.6	9%	0.089	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	134.7	160.4	-173.7	166.5	-3.7	0	0	110.3	I252	Q242-I252 HydrophobicContact CB-CD1 3.91Å; Q242-I252 HydrophobicContact CG-CD1 4.49Å
243	E	72.2	Confident	69.2	Low	96 Å²	96	58.2 Å²	58.2	45%	0.449	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	140.2	163.8	-175.2	156.8	-110.9	0	0	109.5	Q131 V133	Q131-E243 PolarHBondContact O-N 2.86Å; V133-E243 HydrophobicContact CB-CB 4.33Å; V133-E243 HydrophobicContact CG2-CB 3.62Å; V133-E243 HydrophobicContact CG2-CG 4.39Å; V133-E243 WeakPolarHBondContact CG2-OE2 3.2Å
244	G	63.5	Low	69.1	Low	31 Å²	31	59.4 Å²	59.4	32%	0.32	29%	0.291	S	S	.	.			trans	-174.3	121.4	-175.3	0	0	0	0	0	112.9	M246 Q249	G244-M246 PolarHBondContact O-N 3.47Å; G244-Q249 PolarHBondContact O-NE2 3.4Å
245	F	55	Low	68.6	Low	180 Å²	180	60.5 Å²	60.5	79%	0.789	30%	0.298	S	S	*	.	S	Bend	trans	-78.1	1.4	177.4	-57.8	-82.1	0	0	0	113.6
246	M	55.4	Low	67.5	Low	111 Å²	111	67 Å²	67	55%	0.547	33%	0.327	S	S	.	.	S	Bend	trans	-95.1	137.1	-174.5	-61.3	-60	131.1	0	0	111.7	G244 T248	G244-M246 PolarHBondContact O-N 3.47Å; M246-T248 PolarHBondContact O-N 3.35Å
247	K	49.3	Very low	65.9	Low	221 Å²	221	78.6 Å²	78.6	96%	0.961	37%	0.37	S	S	*	.	S	Bend	trans	-65.1	-16.1	175.8	-70.8	-173.8	175.6	-177.7	0	114
248	T	54.4	Low	64.5	Low	120 Å²	120	82 Å²	82	74%	0.736	38%	0.383	S	S	*	.	S	Bend	trans	-126.1	102	177.2	50.9	0	0	0	0	107.9	M246	M246-T248 PolarHBondContact O-N 3.35Å
249	Q	58.5	Low	63.4	Low	68 Å²	68	82.5 Å²	82.5	32%	0.318	39%	0.386	S	S	.	.			trans	-99.8	147.7	174	-59	-174.4	18.6	0	0	109.5	G244	G244-Q249 PolarHBondContact O-NE2 3.4Å
250	P	61.1	Low	62.7	Low	21 Å²	21	80 Å²	80	14%	0.136	38%	0.378	C	S	.	.			trans	-63.4	150	170.8	28.2	-34.4	0	0	0	110.7	A68 I70 W128 I252	A68-P250 WeakPolarHBondContact O-CB 3.43Å; I70-P250 HydrophobicContact CD1-CB 4.07Å; I70-P250 HydrophobicContact CD1-CG 3.72Å; I70-P250 HydrophobicContact CG1-CB 4.39Å; W128-P250 HydrophobicContact CH2-CG 4Å; W128-P250 HydrophobicContact CZ2-CG 4.36Å; P250-I252 PolarHBondContact O-N 3.38Å
251	I	63	Low	62.2	Low	69 Å²	69	82.6 Å²	82.6	35%	0.354	39%	0.392	S	S	.	.			trans	-86.6	112	-178.2	-60.7	179.2	0	0	0	109.2	I70 K253	I70-I251 PolarHBondContact N-O 2.9Å; I251-K253 HydrophobicContact CG2-CG 4.38Å; I251-K253 PolarHBondContact O-N 3.38Å
252	I	67.4	Low	62	Low	10 Å²	10	81.2 Å²	81.2	5%	0.051	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	114.8	172.5	-60.4	-177.5	0	0	0	109.3	I70 L72 L132 Q242 P250	I70-I252 HydrophobicContact CB-CG1 4.37Å; L72-I252 HydrophobicContact CB-CG2 3.72Å; L72-I252 HydrophobicContact CD2-CD1 4.35Å; L72-I252 HydrophobicContact CD2-CG2 3.97Å; L132-I252 HydrophobicContact CD2-CD1 4.02Å; Q242-I252 HydrophobicContact CB-CD1 3.91Å; Q242-I252 HydrophobicContact CG-CD1 4.49Å; P250-I252 PolarHBondContact O-N 3.38Å
253	K	66.3	Low	61.9	Low	104 Å²	104	81.8 Å²	81.8	45%	0.452	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.4	175	-75.6	-168.8	179.1	156.1	0	110	N69 I70 E71 I251 T255	N69-K253 HydrophobicContact CB-CD 3.99Å; N69-K253 HydrophobicContact CB-CG 4.35Å; N69-K253 VanDerWaalsContact OD1-CD 3.28Å; N69-K253 WeakPolarHBondContact OD1-CD 3.21Å; N69-K253 WeakPolarHBondContact OD1-CE 3.14Å; N69-K253 PolarHBondContact OD1-NZ 2.86Å; I70-K253 PolarHBondContact O-N 3.4Å; I70-K253 VanDerWaalsContact O-O 3.1Å; E71-K253 WeakPolarHBondContact CA-O 3.48Å; I251-K253 HydrophobicContact CG2-CG 4.38Å; I251-K253 PolarHBondContact O-N 3.38Å; K253-T255 PolarHBondContact O-N 2.99Å
254	W	63.9	Low	61.9	Low	33 Å²	33	79.8 Å²	79.8	13%	0.125	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	117.3	174.4	-75.9	86.5	0	0	0	110.6	L72 V74 E256 C259 L292	L72-W254 HydrophobicContact CB-CH2 4.06Å; L72-W254 HydrophobicContact CB-CZ2 3.96Å; L72-W254 HydrophobicContact CB-CZ3 4.48Å; L72-W254 HydrophobicContact CD2-CH2 3.75Å; L72-W254 HydrophobicContact CD2-CZ2 3.33Å; L72-W254 HydrophobicContact CG-CH2 3.46Å; L72-W254 VanDerWaalsContact CG-CH2 3.46Å; L72-W254 HydrophobicContact CG-CZ2 3.52Å; L72-W254 HydrophobicContact CG-CZ3 4.23Å; L72-W254 VanDerWaalsContact O-CE3 3.22Å; L72-W254 VanDerWaalsContact O-CZ3 3.29Å; L72-W254 WeakPolarHBondContact O-CZ3 3.23Å; V74-W254 HydrophobicContact CG2-CH2 3.86Å; V74-W254 HydrophobicContact CG2-CZ3 4.08Å; W254-E256 PolarHBondContact O-N 3.11Å; W254-C259 HydrophobicContact CE3-CB 4.15Å; W254-C259 VanDerWaalsContact CE3-SG 3.53Å; W254-C259 HydrophobicContact CZ3-CB 4.43Å; W254-L292 HydrophobicContact CD2-CD1 3.59Å; W254-L292 HydrophobicContact CD2-CG 4.5Å; W254-L292 HydrophobicContact CE3-CD1 3.64Å; W254-L292 HydrophobicContact CE3-CD2 4.47Å; W254-L292 HydrophobicContact CG-CD1 4.3Å; W254-L292 HydrophobicContact CH2-CB 4.29Å; W254-L292 HydrophobicContact CH2-CD1 3.89Å; W254-L292 HydrophobicContact CH2-CD2 3.22Å; W254-L292 HydrophobicContact CH2-CG 3.94Å; W254-L292 HydrophobicContact CZ2-CB 3.62Å; W254-L292 HydrophobicContact CZ2-CD1 3.76Å; W254-L292 HydrophobicContact CZ2-CD2 3.47Å; W254-L292 VanDerWaalsContact CZ2-CD2 3.47Å; W254-L292 HydrophobicContact CZ2-CG 3.76Å; W254-L292 HydrophobicContact CZ3-CD1 3.82Å; W254-L292 HydrophobicContact CZ3-CD2 3.77Å; W254-L292 HydrophobicContact CZ3-CG 4.32Å
255	T	61.6	Low	62	Low	30 Å²	30	82.4 Å²	82.4	18%	0.184	39%	0.392	C	S	.	.			trans	-91.7	77.5	-176.8	44	0	0	0	0	111.5	E71 K253 R257 K258 C259	E71-T255 HydrophobicContact CB-CG2 3.87Å; E71-T255 HydrophobicContact CG-CG2 3.61Å; E71-T255 WeakPolarHBondContact OE1-CG2 2.99Å; K253-T255 PolarHBondContact O-N 2.99Å; T255-R257 PolarHBondContact O-N 3.23Å; T255-K258 PolarHBondContact O-N 3.27Å; T255-C259 PolarHBondContact N-SG 3.43Å; T255-C259 PolarHBondContact O-N 3.24Å; T255-C259 PolarHBondContact O-SG 3.37Å
256	E	55.3	Low	62.5	Low	159 Å²	159	73.8 Å²	73.8	74%	0.743	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.3	-28.3	-170.2	-60.8	175.2	167.4	0	0	117	W254	W254-E256 PolarHBondContact O-N 3.11Å
257	R	49.8	Very low	63.1	Low	243 Å²	243	73.4 Å²	73.4	92%	0.917	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-12.5	179.9	-56.6	-178.5	-174.2	172.7	2.4	115.9	T255	T255-R257 PolarHBondContact O-N 3.23Å
258	K	54.5	Low	63.7	Low	95 Å²	95	72.6 Å²	72.6	41%	0.413	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-19.2	171.8	-68.9	-179	178.5	174.9	0	112.7	E71 E99 T255 C260	E71-K258 IonicContact OE2-NZ 3.41Å; E71-K258 PolarHBondContact OE2-NZ 2.97Å; E99-K258 IonicContact OE2-NZ 2.77Å; E99-K258 PolarHBondContact OE2-NZ 3.39Å; T255-K258 PolarHBondContact O-N 3.27Å; K258-C260 PolarHBondContact O-N 3.38Å
259	C	62.1	Low	64.2	Low	11 Å²	11	71.1 Å²	71.1	7%	0.074	33%	0.325	C	S	.	.	S	Bend	trans	-72.4	-20.1	-148	-83.8	0	0	0	0	119.5	L72 V74 W254 T255	L72-C259 PolarHBondContact O-SG 2.9Å; V74-C259 PolarHBondContact N-O 3.25Å; W254-C259 HydrophobicContact CE3-CB 4.15Å; W254-C259 VanDerWaalsContact CE3-SG 3.53Å; W254-C259 HydrophobicContact CZ3-CB 4.43Å; T255-C259 PolarHBondContact N-SG 3.43Å; T255-C259 PolarHBondContact O-N 3.24Å; T255-C259 PolarHBondContact O-SG 3.37Å
260	C	68.4	Low	64.5	Low	12 Å²	12	68.1 Å²	68.1	8%	0.081	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	109.2	-176.4	-168.2	0	0	0	0	111.8	V74 K258 V275 C669 Q670	V74-C260 VanDerWaalsContact O-CA 3.29Å; V74-C260 WeakPolarHBondContact O-CA 3.05Å; K258-C260 PolarHBondContact O-N 3.38Å; C260-V275 HydrophobicContact CB-CG2 3.67Å; C260-C669 HydrophobicContact CB-CB 3.62Å; C260-C669 WeakPolarHBondContact CB-SG 3.3Å; C260-C669 WeakPolarHBondContact O-CA 3.09Å; C260-C669 WeakPolarHBondContact SG-CB 3.27Å; C260-C669 CovalentContact SG-SG 2.03Å; C260-C669 PolarHBondContact SG-SG 3.5Å; C260-Q670 PolarHBondContact O-N 2.89Å
261	L	71.7	Confident	64.4	Low	60 Å²	60	70.5 Å²	70.5	31%	0.314	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.3	-178.3	-66.9	179.6	0	0	0	110.9	V74 S75 V76 Q670 I672	V74-L261 PolarHBondContact O-N 3.16Å; S75-L261 CarbonylContact C-O 3.57Å; S75-L261 WeakPolarHBondContact CA-O 3.47Å; V76-L261 PolarHBondContact N-O 3.48Å; L261-Q670 CarbonylContact C-O 3.54Å; L261-Q670 WeakPolarHBondContact CA-O 3.33Å; L261-I672 HydrophobicContact CB-CD1 3.76Å; L261-I672 HydrophobicContact CB-CG1 3.83Å; L261-I672 HydrophobicContact CD1-CD1 4.2Å; L261-I672 HydrophobicContact CD1-CG1 4.33Å; L261-I672 HydrophobicContact CD2-CG1 4.18Å; L261-I672 HydrophobicContact CG-CD1 4.48Å; L261-I672 HydrophobicContact CG-CG1 4.34Å
262	L	74.1	Confident	64.3	Low	13 Å²	13	69.5 Å²	69.5	7%	0.068	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.1	-171.6	-165.1	64.2	0	0	0	112	V76 V266 Q267 L273 Q670 I672	V76-L262 HydrophobicContact CB-CD1 3.92Å; V76-L262 HydrophobicContact CG1-CD1 4.34Å; L262-V266 HydrophobicContact CD1-CB 3.65Å; L262-V266 HydrophobicContact CD1-CG1 3.43Å; L262-V266 VanDerWaalsContact CD1-CG1 3.43Å; L262-V266 HydrophobicContact CD1-CG2 4.47Å; L262-V266 HydrophobicContact CG-CB 4.11Å; L262-V266 HydrophobicContact CG-CG1 4.3Å; L262-Q267 HydrophobicContact CD2-CB 4.16Å; L262-L273 HydrophobicContact CD1-CD2 3.7Å; L262-Q670 PolarHBondContact N-O 2.98Å; L262-I672 PolarHBondContact O-N 2.88Å
263	S	72	Confident	64.1	Low	31 Å²	31	69.3 Å²	69.3	22%	0.217	32%	0.32	C	S	.	.			trans	-70.4	141.8	168.9	174.5	0	0	0	0	111.6	V76 D77 D265 V266 Q267	V76-S263 PolarHBondContact O-N 2.76Å; D77-S263 WeakPolarHBondContact O-CB 3.37Å; S263-D265 PolarHBondContact O-N 2.99Å; S263-V266 WeakPolarHBondContact O-CB 3.25Å; S263-V266 PolarHBondContact O-N 3.48Å; S263-Q267 PolarHBondContact O-N 2.82Å
264	N	72	Confident	64	Low	54 Å²	54	64.3 Å²	64.3	29%	0.289	30%	0.298	S	S	.	.	H	α-helix	trans	-52.7	-37.3	-179.7	-83.2	-44.6	0	0	0	113.7	V266 Q267 I671	N264-V266 VanDerWaalsContact C-N 3.28Å; N264-V266 PolarHBondContact O-N 3.43Å; N264-Q267 PolarHBondContact O-N 3.01Å; N264-I671 VanDerWaalsContact OD1-CG2 3.28Å; N264-I671 WeakPolarHBondContact OD1-CG2 3.39Å
265	D	65.9	Low	64	Low	85 Å²	85	63.3 Å²	63.3	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-73.7	-19.8	179.2	-72.8	-41.7	0	0	0	113.3	S263 R268 K269	S263-D265 PolarHBondContact O-N 2.99Å; D265-R268 IonicContact OD1-CZ 3.86Å; D265-R268 IonicContact OD1-NH1 2.81Å; D265-R268 PolarHBondContact OD1-NH1 3.42Å; D265-K269 WeakPolarHBondContact O-CG 3.14Å
266	V	66.6	Low	63.9	Low	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-74.9	-40.6	173.4	-176.4	0	0	0	0	110.7	V76 L79 L262 S263 N264 R268 K269 S270	V76-V266 HydrophobicContact CG1-CG1 4.16Å; L79-V266 HydrophobicContact CB-CG1 4.05Å; L79-V266 HydrophobicContact CD1-CG1 3.44Å; L79-V266 VanDerWaalsContact CD1-CG1 3.44Å; L79-V266 HydrophobicContact CG-CG1 3.52Å; L262-V266 HydrophobicContact CD1-CB 3.65Å; L262-V266 HydrophobicContact CD1-CG1 3.43Å; L262-V266 VanDerWaalsContact CD1-CG1 3.43Å; L262-V266 HydrophobicContact CD1-CG2 4.47Å; L262-V266 HydrophobicContact CG-CB 4.11Å; L262-V266 HydrophobicContact CG-CG1 4.3Å; S263-V266 WeakPolarHBondContact O-CB 3.25Å; S263-V266 PolarHBondContact O-N 3.48Å; N264-V266 VanDerWaalsContact C-N 3.28Å; N264-V266 PolarHBondContact O-N 3.43Å; V266-R268 PolarHBondContact O-N 2.93Å; V266-K269 PolarHBondContact O-N 3.28Å; V266-S270 PolarHBondContact O-N 2.88Å; V266-S270 PolarHBondContact O-OG 3.42Å; V266-S270 VanDerWaalsContact O-OG 3.09Å
267	Q	66.6	Low	64.1	Low	102 Å²	102	59.4 Å²	59.4	48%	0.477	28%	0.277	S	S	.	.	H	α-helix	trans	-58.1	-30.6	175	-166.3	-169.8	8.3	0	0	112.5	L262 S263 N264	L262-Q267 HydrophobicContact CD2-CB 4.16Å; S263-Q267 PolarHBondContact O-N 2.82Å; N264-Q267 PolarHBondContact O-N 3.01Å
268	R	63.2	Low	64.4	Low	204 Å²	204	54.1 Å²	54.1	77%	0.77	26%	0.257	S	S	*	.	H	α-helix	trans	-72.2	-26.3	173.6	-67.7	174.1	172	157	-6.5	113.6	D265 V266	D265-R268 IonicContact OD1-CZ 3.86Å; D265-R268 IonicContact OD1-NH1 2.81Å; D265-R268 PolarHBondContact OD1-NH1 3.42Å; V266-R268 PolarHBondContact O-N 2.93Å
269	K	64	Low	64.3	Low	90 Å²	90	57.1 Å²	57.1	39%	0.391	27%	0.266	S	S	.	.	H	α-helix	trans	-96	-33.4	-177	-65.8	-178.5	-172.1	-177.9	0	113.3	N78 L79 D265 V266	N78-K269 PolarHBondContact OD1-NZ 2.9Å; L79-K269 WeakPolarHBondContact O-CD 3.37Å; L79-K269 PolarHBondContact O-NZ 3.23Å; D265-K269 WeakPolarHBondContact O-CG 3.14Å; V266-K269 PolarHBondContact O-N 3.28Å
270	S	64.4	Low	63.5	Low	4 Å²	4	58.6 Å²	58.6	3%	0.028	27%	0.274	C	S	.	.			trans	-120	126.6	178.9	60.8	0	0	0	0	111.4	V266	V266-S270 PolarHBondContact O-N 2.88Å; V266-S270 PolarHBondContact O-OG 3.42Å; V266-S270 VanDerWaalsContact O-OG 3.09Å
271	S	59.4	Low	62.1	Low	72 Å²	72	66.5 Å²	66.5	50%	0.503	31%	0.309	S	S	.	.	S	Bend	trans	-73	-25.5	-179.2	55.8	0	0	0	0	114.8	C297 S299	S271-C297 PolarHBondContact OG-O 2.85Å; S271-S299 WeakPolarHBondContact OG-CA 3.43Å; S271-S299 WeakPolarHBondContact OG-CB 3.43Å; S271-S299 PolarHBondContact OG-N 2.81Å
272	Y	60.8	Low	60.4	Low	47 Å²	47	71.1 Å²	71.1	18%	0.184	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	140.7	-177.3	-151	-72	0	0	0	109.7	C297 L659 C663 L668	Y272-C297 PolarHBondContact N-O 3.01Å; Y272-C297 CarbonylContact O-C 3.51Å; Y272-C297 WeakPolarHBondContact O-CA 3.38Å; Y272-C297 WeakPolarHBondContact O-CB 3.34Å; Y272-C297 PolarHBondContact O-N 3.45Å; Y272-C297 VanDerWaalsContact O-N 3.12Å; Y272-L659 HydrophobicContact CD2-CD2 3.66Å; Y272-L659 HydrophobicContact CE2-CD2 4.23Å; Y272-L659 HydrophobicContact CG-CD2 4.04Å; Y272-C663 VanDerWaalsContact CD1-O 3.27Å; Y272-C663 WeakPolarHBondContact CD1-O 3.23Å; Y272-C663 WeakPolarHBondContact CE1-O 3.42Å; Y272-L668 HydrophobicContact CD1-CD2 4.19Å; Y272-L668 HydrophobicContact CE1-CD2 3.55Å; Y272-L668 HydrophobicContact CE1-CG 4.04Å; Y272-L668 HydrophobicContact CE2-CD2 4.05Å
273	L	64.2	Low	58.9	Low	6 Å²	6	76.6 Å²	76.6	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	115.6	172.4	-178.4	64.1	0	0	0	107.5	V76 L262 I294 I296 C669	V76-L273 HydrophobicContact CB-CD2 4.25Å; V76-L273 HydrophobicContact CG2-CD2 3.74Å; L262-L273 HydrophobicContact CD1-CD2 3.7Å; L273-I294 HydrophobicContact CD1-CG2 3.74Å; L273-I296 HydrophobicContact CD1-CB 4.16Å; L273-I296 HydrophobicContact CD1-CG1 3.69Å; L273-C669 HydrophobicContact CD2-CB 4.12Å; L273-C669 WeakPolarHBondContact CD2-SG 3.42Å; L273-C669 VanDerWaalsContact CG-SG 3.52Å
274	S	63.7	Low	57.4	Low	0 Å²	0	81 Å²	81	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137.2	175	56	0	0	0	0	110.4	N295 T662 C663	S274-N295 PolarHBondContact N-O 3.19Å; S274-N295 PolarHBondContact O-N 2.88Å; S274-T662 PolarHBondContact OG-O 3.41Å; S274-C663 VanDerWaalsContact CB-O 3.29Å; S274-C663 WeakPolarHBondContact CB-O 3.39Å; S274-C663 PolarHBondContact OG-O 3.35Å
275	V	62.8	Low	55.9	Low	11 Å²	11	88 Å²	88	7%	0.067	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.4	164.1	-175.2	0	0	0	0	107.9	C260 L292 I294 S667	C260-V275 HydrophobicContact CB-CG2 3.67Å; V275-L292 HydrophobicContact CG1-CD1 3.57Å; V275-L292 HydrophobicContact CG1-CG 4.4Å; V275-I294 HydrophobicContact CG1-CG1 4.42Å; V275-I294 HydrophobicContact CG2-CG1 4.27Å; V275-S667 PolarHBondContact N-O 3.04Å; V275-S667 PolarHBondContact O-OG 3.15Å
276	T	60.9	Low	54.7	Low	33 Å²	33	88.4 Å²	88.4	20%	0.202	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	99.8	178.1	59.5	0	0	0	0	108.8	R278 G293 N295	T276-R278 PolarHBondContact O-N 2.91Å; T276-R278 VanDerWaalsContact O-N 3.1Å; T276-G293 CarbonylContact C-O 3.58Å; T276-G293 PolarHBondContact N-O 3Å; T276-G293 WeakPolarHBondContact O-CA 3.48Å; T276-G293 PolarHBondContact O-N 2.93Å; T276-G293 VanDerWaalsContact O-N 3.14Å; T276-G293 PolarHBondContact OG1-O 3.39Å; T276-N295 WeakPolarHBondContact CG2-ND2 3.46Å; T276-N295 PolarHBondContact OG1-ND2 3.4Å
277	K	59.4	Low	53.8	Low	75 Å²	75	91.3 Å²	91.3	33%	0.326	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	115.7	167.5	-170.5	-179.2	-175.4	-170.6	0	108	Y279	K277-Y279 HydrophobicContact CD-CE1 4.27Å; K277-Y279 HydrophobicContact CD-CE2 4.38Å; K277-Y279 WeakPolarHBondContact CE-OH 3.41Å; K277-Y279 PolarHBondContact NZ-OH 3.1Å
278	R	55.8	Low	53	Low	132 Å²	132	92.2 Å²	92.2	50%	0.498	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	115.1	-179.9	-173.4	-178.6	-178	92.1	8	107.9	W239 T276 D280 S291	W239-R278 HydrophobicContact CZ3-CB 3.86Å; W239-R278 HydrophobicContact CZ3-CG 4.35Å; T276-R278 PolarHBondContact O-N 2.91Å; T276-R278 VanDerWaalsContact O-N 3.1Å; R278-D280 WeakPolarHBondContact CD-OD1 3.4Å; R278-D280 IonicContact NE-OD1 3.3Å; R278-D280 PolarHBondContact NE-OD1 2.68Å; R278-D280 VanDerWaalsContact NE-OD1 3.09Å; R278-D280 PolarHBondContact O-N 3.41Å; R278-S291 PolarHBondContact O-OG 3.16Å
279	Y	52.2	Low	52.6	Low	157 Å²	157	85.1 Å²	85.1	62%	0.616	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	114.5	162.8	-55.4	-79.3	0	0	0	106.3	K277 E281	K277-Y279 HydrophobicContact CD-CE1 4.27Å; K277-Y279 HydrophobicContact CD-CE2 4.38Å; K277-Y279 WeakPolarHBondContact CE-OH 3.41Å; K277-Y279 PolarHBondContact NZ-OH 3.1Å; Y279-E281 PolarHBondContact O-N 3.02Å
280	D	45.6	Very low	52.4	Low	43 Å²	43	84 Å²	84	23%	0.23	43%	0.434	C	S	.	.			trans	-76.2	90.8	179	-90	-37	0	0	0	110.2	R278 H282 S291	R278-D280 WeakPolarHBondContact CD-OD1 3.4Å; R278-D280 IonicContact NE-OD1 3.3Å; R278-D280 PolarHBondContact NE-OD1 2.68Å; R278-D280 VanDerWaalsContact NE-OD1 3.09Å; R278-D280 PolarHBondContact O-N 3.41Å; D280-H282 PolarHBondContact O-N 3.48Å; D280-S291 PolarHBondContact OD2-OG 3.39Å
281	E	37.9	Very low	52.5	Low	177 Å²	177	84.1 Å²	84.1	83%	0.827	44%	0.435	S	S	*	.			trans	-73.8	101.8	167	-171.3	166.8	-139.5	0	0	109.4	Y279	Y279-E281 PolarHBondContact O-N 3.02Å
282	H	36.6	Very low	53.1	Low	157 Å²	157	80.8 Å²	80.8	73%	0.727	41%	0.411	S	S	*	.	S	Bend	trans	57.8	82.8	173.8	-79.7	75.7	0	0	0	116.6	D280	D280-H282 PolarHBondContact O-N 3.48Å
283	I	43.1	Very low	53.9	Low	128 Å²	128	78.6 Å²	78.6	66%	0.656	40%	0.402	S	S	*	.	S	Bend	trans	-103.9	-41.4	149.6	-64.9	-179	0	0	0	110.6
284	D	40.4	Very low	54.6	Low	124 Å²	124	78.3 Å²	78.3	66%	0.663	40%	0.401	S	S	*	.	S	Bend	trans	-129.8	157.3	173.1	-77.7	-63.7	0	0	0	111.3	S286	D284-S286 PolarHBondContact O-N 3.29Å
285	K	40.5	Very low	55.3	Low	201 Å²	201	78.8 Å²	78.8	87%	0.874	40%	0.403	S	S	*	.	S	Bend	trans	-77.9	48.3	-178.2	-64.3	-178.3	177.5	179.1	0	113.1
286	S	41.1	Very low	56	Low	94 Å²	94	78.2 Å²	78.2	66%	0.657	40%	0.4	S	S	*	.	S	Bend	trans	-142.7	66.2	-173.2	-112.7	0	0	0	0	114.5	D284	D284-S286 PolarHBondContact O-N 3.29Å
287	G	46.4	Very low	56.7	Low	60 Å²	60	76.7 Å²	76.7	62%	0.619	39%	0.391	S	S	*	.			trans	74.5	174.4	165	0	0	0	0	0	116.1	D289	G287-D289 VanDerWaalsContact C-N 3.27Å; G287-D289 PolarHBondContact O-N 3.06Å
288	P	51.5	Low	57.3	Low	122 Å²	122	73.6 Å²	73.6	79%	0.792	38%	0.377	S	S	*	.			trans	-80.5	73.5	177.4	33.8	-34.7	0	0	0	110.8	Q290	P288-Q290 PolarHBondContact O-N 3.41Å; P288-Q290 VanDerWaalsContact O-N 3.15Å
289	D	53.8	Low	57.9	Low	55 Å²	55	69 Å²	69	29%	0.294	37%	0.365	S	S	.	.			trans	-57.7	112.6	171.8	-91.7	-27.9	0	0	0	110.5	K241 G287 S291	K241-D289 WeakPolarHBondContact CE-OD1 3.33Å; K241-D289 WeakPolarHBondContact CE-OD2 3.4Å; K241-D289 IonicContact NZ-OD1 2.78Å; K241-D289 PolarHBondContact NZ-OD1 2.99Å; K241-D289 IonicContact NZ-OD2 3.58Å; K241-D289 PolarHBondContact NZ-OD2 3.48Å; G287-D289 VanDerWaalsContact C-N 3.27Å; G287-D289 PolarHBondContact O-N 3.06Å; D289-S291 PolarHBondContact O-N 2.86Å; D289-S291 VanDerWaalsContact O-N 3.12Å
290	Q	60.6	Low	58.7	Low	66 Å²	66	62 Å²	62	31%	0.308	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	93.1	177.7	-62.4	-164.9	39.6	0	0	110.5	P288	P288-Q290 PolarHBondContact O-N 3.41Å; P288-Q290 VanDerWaalsContact O-N 3.15Å
291	S	65.9	Low	59.7	Low	7 Å²	7	62.2 Å²	62.2	5%	0.049	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	152.8	171.2	62.1	0	0	0	0	111.7	R278 D280 D289	R278-S291 PolarHBondContact O-OG 3.16Å; D280-S291 PolarHBondContact OD2-OG 3.39Å; D289-S291 PolarHBondContact O-N 2.86Å; D289-S291 VanDerWaalsContact O-N 3.12Å
292	L	72.7	Confident	61.2	Low	2 Å²	2	55.7 Å²	55.7	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.1	166.4	177.6	85.2	0	0	0	108.8	W239 I240 W254 V275 I294	W239-L292 CarbonylContact C-O 3.53Å; W239-L292 VanDerWaalsContact CA-O 3.27Å; W239-L292 WeakPolarHBondContact CA-O 3.24Å; I240-L292 HydrophobicContact CB-CB 4.31Å; I240-L292 HydrophobicContact CB-CD2 4.38Å; I240-L292 HydrophobicContact CD1-CD2 3.89Å; I240-L292 HydrophobicContact CG1-CD2 4.2Å; I240-L292 PolarHBondContact N-O 3.12Å; I240-L292 PolarHBondContact O-N 2.97Å; W254-L292 HydrophobicContact CD2-CD1 3.59Å; W254-L292 HydrophobicContact CD2-CG 4.5Å; W254-L292 HydrophobicContact CE3-CD1 3.64Å; W254-L292 HydrophobicContact CE3-CD2 4.47Å; W254-L292 HydrophobicContact CG-CD1 4.3Å; W254-L292 HydrophobicContact CH2-CB 4.29Å; W254-L292 HydrophobicContact CH2-CD1 3.89Å; W254-L292 HydrophobicContact CH2-CD2 3.22Å; W254-L292 HydrophobicContact CH2-CG 3.94Å; W254-L292 HydrophobicContact CZ2-CB 3.62Å; W254-L292 HydrophobicContact CZ2-CD1 3.76Å; W254-L292 HydrophobicContact CZ2-CD2 3.47Å; W254-L292 VanDerWaalsContact CZ2-CD2 3.47Å; W254-L292 HydrophobicContact CZ2-CG 3.76Å; W254-L292 HydrophobicContact CZ3-CD1 3.82Å; W254-L292 HydrophobicContact CZ3-CD2 3.77Å; W254-L292 HydrophobicContact CZ3-CG 4.32Å; V275-L292 HydrophobicContact CG1-CD1 3.57Å; V275-L292 HydrophobicContact CG1-CG 4.4Å; L292-I294 HydrophobicContact CD2-CD1 3.8Å; L292-I294 HydrophobicContact CD2-CG1 3.6Å; L292-I294 HydrophobicContact CG-CG1 4.32Å
293	G	76.5	Confident	62.9	Low	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.6	159.7	0	0	0	0	0	111.8	V238 W239 T276	V238-G293 WeakPolarHBondContact O-CA 3.38Å; W239-G293 VanDerWaalsContact CE3-CA 3.42Å; T276-G293 CarbonylContact C-O 3.58Å; T276-G293 PolarHBondContact N-O 3Å; T276-G293 WeakPolarHBondContact O-CA 3.48Å; T276-G293 PolarHBondContact O-N 2.93Å; T276-G293 VanDerWaalsContact O-N 3.14Å; T276-G293 PolarHBondContact OG1-O 3.39Å
294	I	78.3	Confident	64.6	Low	1 Å²	1	48.8 Å²	48.8	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.9	159.9	-61	168.7	0	0	0	107.2	V74 P237 V238 I240 L273 V275 L292 I296	V74-I294 HydrophobicContact CB-CD1 4.23Å; V74-I294 HydrophobicContact CG1-CD1 3.92Å; V74-I294 HydrophobicContact CG2-CD1 4.14Å; P237-I294 WeakPolarHBondContact CA-O 3.38Å; V238-I294 HydrophobicContact CB-CB 4.34Å; V238-I294 PolarHBondContact N-O 3.48Å; V238-I294 PolarHBondContact O-N 3.42Å; I240-I294 HydrophobicContact CD1-CD1 4.4Å; L273-I294 HydrophobicContact CD1-CG2 3.74Å; V275-I294 HydrophobicContact CG1-CG1 4.42Å; V275-I294 HydrophobicContact CG2-CG1 4.27Å; L292-I294 HydrophobicContact CD2-CD1 3.8Å; L292-I294 HydrophobicContact CD2-CG1 3.6Å; L292-I294 HydrophobicContact CG-CG1 4.32Å; I294-I296 HydrophobicContact CG2-CG1 4.33Å
295	N	78.5	Confident	66.5	Low	9 Å²	9	46.9 Å²	46.9	5%	0.048	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	98.5	178.7	-66	-28.7	0	0	0	109.1	V235 S274 T276 C297 T662	V235-N295 HydrophobicContact CG1-CB 4.18Å; S274-N295 PolarHBondContact N-O 3.19Å; S274-N295 PolarHBondContact O-N 2.88Å; T276-N295 WeakPolarHBondContact CG2-ND2 3.46Å; T276-N295 PolarHBondContact OG1-ND2 3.4Å; N295-C297 PolarHBondContact O-N 3.16Å; N295-T662 PolarHBondContact ND2-O 2.98Å
296	I	78.3	Confident	68.5	Low	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	120.7	172.5	-57.4	164.6	0	0	0	107.7	L79 A92 V235 C236 V238 L273 I294 F298	L79-I296 HydrophobicContact CD1-CG2 3.58Å; L79-I296 HydrophobicContact CD2-CD1 3.8Å; L79-I296 HydrophobicContact CD2-CG1 4.49Å; L79-I296 HydrophobicContact CD2-CG2 4.44Å; A92-I296 HydrophobicContact CB-CD1 4.04Å; V235-I296 WeakPolarHBondContact CA-O 3.31Å; C236-I296 HydrophobicContact CB-CB 4.29Å; C236-I296 PolarHBondContact N-O 2.93Å; C236-I296 PolarHBondContact O-N 2.87Å; V238-I296 HydrophobicContact CG2-CD1 3.76Å; V238-I296 HydrophobicContact CG2-CG1 4.48Å; L273-I296 HydrophobicContact CD1-CB 4.16Å; L273-I296 HydrophobicContact CD1-CG1 3.69Å; I294-I296 HydrophobicContact CG2-CG1 4.33Å; I296-F298 HydrophobicContact CG2-CD2 4.18Å; I296-F298 HydrophobicContact CG2-CE1 4.39Å; I296-F298 HydrophobicContact CG2-CE2 3.48Å; I296-F298 VanDerWaalsContact CG2-CE2 3.48Å; I296-F298 HydrophobicContact CG2-CZ 3.61Å
297	C	76	Confident	70.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	99.9	-171.3	-74.1	0	0	0	0	112.6	A233 I234 S271 Y272 N295 S299 C663	A233-C297 HydrophobicContact CB-CB 4.24Å; I234-C297 WeakPolarHBondContact O-CA 3.19Å; S271-C297 PolarHBondContact OG-O 2.85Å; Y272-C297 PolarHBondContact N-O 3.01Å; Y272-C297 CarbonylContact O-C 3.51Å; Y272-C297 WeakPolarHBondContact O-CA 3.38Å; Y272-C297 WeakPolarHBondContact O-CB 3.34Å; Y272-C297 PolarHBondContact O-N 3.45Å; Y272-C297 VanDerWaalsContact O-N 3.12Å; N295-C297 PolarHBondContact O-N 3.16Å; C297-S299 PolarHBondContact O-N 3.01Å; C297-C663 HydrophobicContact CB-CB 3.82Å; C297-C663 WeakPolarHBondContact CB-SG 3.36Å; C297-C663 VanDerWaalsContact SG-CA 3.54Å; C297-C663 WeakPolarHBondContact SG-CB 3.49Å; C297-C663 CovalentContact SG-SG 2.04Å; C297-C663 PolarHBondContact SG-SG 2.93Å
298	F	72.3	Confident	72.5	Confident	11 Å²	11	37.7 Å²	37.7	5%	0.048	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	108.7	175.9	-56.3	-84.8	0	0	0	111.1	L79 L81 C90 A233 I234 I296 Q300	L79-F298 HydrophobicContact CB-CZ 4.43Å; L79-F298 HydrophobicContact CD1-CE1 4.44Å; L79-F298 HydrophobicContact CD1-CZ 4.27Å; L81-F298 HydrophobicContact CD1-CD2 4.42Å; L81-F298 HydrophobicContact CD1-CE2 4.18Å; C90-F298 HydrophobicContact CB-CE2 4.39Å; A233-F298 CarbonylContact C-O 3.56Å; A233-F298 VanDerWaalsContact CA-O 3.27Å; A233-F298 WeakPolarHBondContact CA-O 3.15Å; I234-F298 HydrophobicContact CB-CB 4.22Å; I234-F298 HydrophobicContact CB-CD2 4.37Å; I234-F298 PolarHBondContact N-O 2.77Å; I234-F298 PolarHBondContact O-N 3.18Å; I296-F298 HydrophobicContact CG2-CD2 4.18Å; I296-F298 HydrophobicContact CG2-CE1 4.39Å; I296-F298 HydrophobicContact CG2-CE2 3.48Å; I296-F298 VanDerWaalsContact CG2-CE2 3.48Å; I296-F298 HydrophobicContact CG2-CZ 3.61Å; F298-Q300 PolarHBondContact O-N 3.23Å
299	S	68.6	Low	74.3	Confident	34 Å²	34	35.6 Å²	35.6	24%	0.238	19%	0.189	C	C	.	.			trans	-65.1	125.3	171.7	-179.9	0	0	0	0	110.8	S271 C297 S301	S271-S299 WeakPolarHBondContact OG-CA 3.43Å; S271-S299 WeakPolarHBondContact OG-CB 3.43Å; S271-S299 PolarHBondContact OG-N 2.81Å; C297-S299 PolarHBondContact O-N 3.01Å; S299-S301 PolarHBondContact OG-N 3.18Å; S299-S301 PolarHBondContact OG-OG 3.4Å
300	Q	67.6	Low	76.2	Confident	12 Å²	12	35.1 Å²	35.1	6%	0.056	19%	0.188	C	C	.	.	S	Bend	trans	-80	-24.7	176	-59.6	176.2	-11.9	0	0	111.7	I231 G232 I234 F298 G302 R303 I304 L360	I231-Q300 HydrophobicContact CG2-CB 3.88Å; G232-Q300 PolarHBondContact O-NE2 3.45Å; G232-Q300 VanDerWaalsContact O-NE2 3.07Å; G232-Q300 PolarHBondContact O-OE1 3.15Å; I234-Q300 HydrophobicContact CD1-CG 4.46Å; I234-Q300 HydrophobicContact CG1-CG 4.05Å; I234-Q300 VanDerWaalsContact CG1-NE2 3.31Å; F298-Q300 PolarHBondContact O-N 3.23Å; Q300-G302 PolarHBondContact O-N 2.9Å; Q300-R303 PolarHBondContact O-N 3.25Å; Q300-I304 HydrophobicContact CB-CD1 4.11Å; Q300-I304 WeakPolarHBondContact O-CG1 3.33Å; Q300-I304 PolarHBondContact O-N 3.2Å; Q300-L360 HydrophobicContact CB-CD1 4.38Å; Q300-L360 HydrophobicContact CB-CD2 4.02Å; Q300-L360 VanDerWaalsContact CD-CD1 3.47Å; Q300-L360 HydrophobicContact CG-CD1 4.28Å; Q300-L360 HydrophobicContact CG-CD2 3.6Å
301	S	67.3	Low	77.7	Confident	46 Å²	46	32 Å²	32	32%	0.322	17%	0.174	S	C	.	.	H	α-helix	trans	-63.4	-40	-169	65.6	0	0	0	0	112.9	S299 I304 L305	S299-S301 PolarHBondContact OG-N 3.18Å; S299-S301 PolarHBondContact OG-OG 3.4Å; S301-I304 PolarHBondContact O-N 3.32Å; S301-L305 WeakPolarHBondContact O-CB 3.43Å; S301-L305 PolarHBondContact O-N 2.96Å
302	G	69.7	Low	78.9	Confident	40 Å²	40	34 Å²	34	41%	0.412	18%	0.183	S	C	.	.	H	α-helix	trans	-62.9	-41.6	176.3	0	0	0	0	0	113.2	Q300 Q306	Q300-G302 PolarHBondContact O-N 2.9Å; G302-Q306 WeakPolarHBondContact O-CB 3.32Å; G302-Q306 PolarHBondContact O-N 3.36Å
303	R	71.4	Confident	79.9	Confident	135 Å²	135	37.8 Å²	37.8	51%	0.509	20%	0.203	S	C	.	.	H	α-helix	trans	-68	-40	176.8	-65.8	-172.4	-178.7	-169.2	1.6	111.8	Q300 G307	Q300-R303 PolarHBondContact O-N 3.25Å; R303-G307 PolarHBondContact O-N 3.41Å
304	I	78.3	Confident	80.8	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-45.8	176.6	-69.9	163.2	0	0	0	110.6	I231 Q300 S301 Q306 G307 S308 L360 F363 I653	I231-I304 HydrophobicContact CD1-CD1 4.37Å; I231-I304 HydrophobicContact CG1-CD1 4.4Å; I231-I304 HydrophobicContact CG2-CD1 3.38Å; Q300-I304 HydrophobicContact CB-CD1 4.11Å; Q300-I304 WeakPolarHBondContact O-CG1 3.33Å; Q300-I304 PolarHBondContact O-N 3.2Å; S301-I304 PolarHBondContact O-N 3.32Å; I304-Q306 PolarHBondContact O-N 2.85Å; I304-G307 PolarHBondContact O-N 3.37Å; I304-S308 VanDerWaalsContact O-CB 3.23Å; I304-S308 WeakPolarHBondContact O-CB 3.28Å; I304-S308 PolarHBondContact O-N 3.01Å; I304-S308 PolarHBondContact O-OG 2.96Å; I304-L360 HydrophobicContact CD1-CD1 4.16Å; I304-F363 HydrophobicContact CD1-CD1 4.43Å; I304-F363 HydrophobicContact CG2-CD1 4.3Å; I304-F363 HydrophobicContact CG2-CE1 4.17Å; I304-I653 HydrophobicContact CG2-CD1 3.77Å; I304-I653 HydrophobicContact CG2-CG1 4.24Å
305	L	80.5	Confident	81.5	Confident	85 Å²	85	38.5 Å²	38.5	45%	0.445	21%	0.207	S	C	.	.	H	α-helix	trans	-57.8	-44.6	176.2	177.6	64.7	0	0	0	112.1	S301 S308 L309 W650	S301-L305 WeakPolarHBondContact O-CB 3.43Å; S301-L305 PolarHBondContact O-N 2.96Å; L305-S308 PolarHBondContact O-OG 3.49Å; L305-L309 WeakPolarHBondContact O-CB 3.46Å; L305-L309 PolarHBondContact O-N 3.22Å; L305-W650 HydrophobicContact CD1-CH2 3.77Å; L305-W650 HydrophobicContact CD1-CZ3 3.66Å
306	Q	82.4	Confident	82.2	Confident	156 Å²	156	42.3 Å²	42.3	73%	0.729	23%	0.227	S	C	*	.	H	α-helix	trans	-67.7	-37.3	177.6	-170	177.2	13.2	0	0	112.3	G302 I304 P310	G302-Q306 WeakPolarHBondContact O-CB 3.32Å; G302-Q306 PolarHBondContact O-N 3.36Å; I304-Q306 PolarHBondContact O-N 2.85Å; Q306-P310 VanDerWaalsContact O-CD 3.24Å; Q306-P310 WeakPolarHBondContact O-CD 3.43Å
307	G	84.9	Confident	82.9	Confident	5 Å²	5	46.3 Å²	46.3	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-79.4	-27.6	179.2	0	0	0	0	0	115.1	R303 I304 P311	R303-G307 PolarHBondContact O-N 3.41Å; I304-G307 PolarHBondContact O-N 3.37Å; G307-P311 WeakPolarHBondContact O-CD 3.07Å
308	S	87.5	Confident	83.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-86.4	-21.9	-175.7	68.5	0	0	0	0	113.9	I304 L305 P311 M312 W367 W650	I304-S308 VanDerWaalsContact O-CB 3.23Å; I304-S308 WeakPolarHBondContact O-CB 3.28Å; I304-S308 PolarHBondContact O-N 3.01Å; I304-S308 PolarHBondContact O-OG 2.96Å; L305-S308 PolarHBondContact O-OG 3.49Å; S308-P311 WeakPolarHBondContact O-CD 3.45Å; S308-P311 WeakPolarHBondContact O-CG 2.99Å; S308-M312 PolarHBondContact O-N 3.41Å; S308-W367 PolarHBondContact O-NE1 3.16Å; S308-W650 WeakPolarHBondContact OG-CH2 3.28Å
309	L	90.3	Very high	84.7	Confident	79 Å²	79	46.7 Å²	46.7	41%	0.414	25%	0.25	S	C	.	.	H	α-helix	trans	-69.6	-44.7	-177.7	-178.1	151.8	0	0	0	114	L305 M312 L313	L305-L309 WeakPolarHBondContact O-CB 3.46Å; L305-L309 PolarHBondContact O-N 3.22Å; L309-M312 HydrophobicContact CG-CE 4.38Å; L309-M312 WeakPolarHBondContact O-CB 3.21Å; L309-M312 PolarHBondContact O-N 3.14Å; L309-L313 HydrophobicContact CD2-CD1 3.72Å; L309-L313 HydrophobicContact CD2-CG 4.36Å; L309-L313 PolarHBondContact O-N 3.34Å; L309-L313 VanDerWaalsContact O-N 3.15Å
310	P	92	Very high	85.8	Confident	44 Å²	44	49.7 Å²	49.7	29%	0.286	26%	0.262	S	S	.	.	H	α-helix	trans	-57.4	-50.6	177	-24	33.6	0	0	0	114.6	Q306 M312 L313 L314 F346	Q306-P310 VanDerWaalsContact O-CD 3.24Å; Q306-P310 WeakPolarHBondContact O-CD 3.43Å; P310-M312 VanDerWaalsContact C-N 3.3Å; P310-M312 PolarHBondContact O-N 3.48Å; P310-L313 WeakPolarHBondContact O-CB 3.49Å; P310-L313 PolarHBondContact O-N 3.44Å; P310-L313 VanDerWaalsContact O-N 3.15Å; P310-L314 WeakPolarHBondContact O-CG 3.06Å; P310-L314 PolarHBondContact O-N 3.06Å; P310-F346 HydrophobicContact CB-CD2 4.29Å; P310-F346 HydrophobicContact CB-CE1 4.24Å; P310-F346 HydrophobicContact CB-CE2 3.71Å; P310-F346 HydrophobicContact CB-CZ 3.68Å; P310-F346 HydrophobicContact CG-CE2 3.91Å; P310-F346 HydrophobicContact CG-CZ 3.78Å
311	P	92.1	Very high	86.9	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-30.4	-178.9	27.3	-33.5	0	0	0	112	G307 S308 L313 L314 V315 F346 C371	G307-P311 WeakPolarHBondContact O-CD 3.07Å; S308-P311 WeakPolarHBondContact O-CD 3.45Å; S308-P311 WeakPolarHBondContact O-CG 2.99Å; P311-L313 VanDerWaalsContact C-N 3.33Å; P311-L313 PolarHBondContact O-N 3.29Å; P311-L314 WeakPolarHBondContact O-CB 3.03Å; P311-L314 PolarHBondContact O-N 3.34Å; P311-V315 WeakPolarHBondContact O-CG2 3.36Å; P311-V315 PolarHBondContact O-N 3.21Å; P311-V315 VanDerWaalsContact O-N 3.08Å; P311-F346 HydrophobicContact CB-CD1 4.42Å; P311-F346 HydrophobicContact CB-CE1 4.46Å; P311-F346 HydrophobicContact CG-CD1 4.42Å; P311-F346 HydrophobicContact CG-CE1 3.98Å; P311-C371 HydrophobicContact CB-CB 3.97Å
312	M	91.3	Very high	87.9	Confident	49 Å²	49	48.6 Å²	48.6	24%	0.241	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-43.5	171.4	-177.7	-174.3	68.8	0	0	111.9	S308 L309 P310 L314 V315 L316 W367 W650	S308-M312 PolarHBondContact O-N 3.41Å; L309-M312 HydrophobicContact CG-CE 4.38Å; L309-M312 WeakPolarHBondContact O-CB 3.21Å; L309-M312 PolarHBondContact O-N 3.14Å; P310-M312 VanDerWaalsContact C-N 3.3Å; P310-M312 PolarHBondContact O-N 3.48Å; M312-L314 VanDerWaalsContact C-N 3.33Å; M312-L314 PolarHBondContact O-N 3.18Å; M312-V315 PolarHBondContact O-N 2.86Å; M312-L316 PolarHBondContact O-N 2.9Å; M312-W367 HydrophobicContact CB-CZ2 4.21Å; M312-W650 HydrophobicContact CE-CZ2 4.35Å; M312-W650 HydrophobicContact SD-CZ2 3.74Å; M312-W650 PolarHBondContact SD-NE1 3.39Å
313	L	94	Very high	88.8	Confident	81 Å²	81	52.4 Å²	52.4	42%	0.424	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-37	175.8	-67.3	174	0	0	0	112	L309 P310 P311 L316 I317	L309-L313 HydrophobicContact CD2-CD1 3.72Å; L309-L313 HydrophobicContact CD2-CG 4.36Å; L309-L313 PolarHBondContact O-N 3.34Å; L309-L313 VanDerWaalsContact O-N 3.15Å; P310-L313 WeakPolarHBondContact O-CB 3.49Å; P310-L313 PolarHBondContact O-N 3.44Å; P310-L313 VanDerWaalsContact O-N 3.15Å; P311-L313 VanDerWaalsContact C-N 3.33Å; P311-L313 PolarHBondContact O-N 3.29Å; L313-L316 PolarHBondContact O-N 3.08Å; L313-I317 VanDerWaalsContact O-CG1 3.29Å; L313-I317 WeakPolarHBondContact O-CG1 3.36Å; L313-I317 PolarHBondContact O-N 3.16Å
314	L	94.9	Very high	89.4	Confident	16 Å²	16	48 Å²	48	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-43.2	175.8	-57.1	178.3	0	0	0	112	P310 P311 M312 I317 S318 L339 F342 I375	P310-L314 WeakPolarHBondContact O-CG 3.06Å; P310-L314 PolarHBondContact O-N 3.06Å; P311-L314 WeakPolarHBondContact O-CB 3.03Å; P311-L314 PolarHBondContact O-N 3.34Å; M312-L314 VanDerWaalsContact C-N 3.33Å; M312-L314 PolarHBondContact O-N 3.18Å; L314-I317 PolarHBondContact O-N 3.46Å; L314-S318 WeakPolarHBondContact O-CB 3.36Å; L314-S318 PolarHBondContact O-N 3.31Å; L314-L339 HydrophobicContact CB-CD1 4.02Å; L314-L339 HydrophobicContact CD2-CD1 3.78Å; L314-L339 HydrophobicContact CG-CD1 4.45Å; L314-F342 HydrophobicContact CD1-CD1 3.65Å; L314-F342 HydrophobicContact CD1-CE1 4.12Å; L314-F342 HydrophobicContact CD2-CD1 3.58Å; L314-F342 HydrophobicContact CD2-CE1 3.83Å; L314-F342 HydrophobicContact CG-CD1 4.26Å; L314-I375 HydrophobicContact CB-CD1 3.86Å
315	V	94	Very high	89	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.8	-37.7	175.9	-166.9	0	0	0	0	111	P311 M312 I317 S318 I319 C371 I375 F642	P311-V315 WeakPolarHBondContact O-CG2 3.36Å; P311-V315 PolarHBondContact O-N 3.21Å; P311-V315 VanDerWaalsContact O-N 3.08Å; M312-V315 PolarHBondContact O-N 2.86Å; V315-I317 PolarHBondContact O-N 3.05Å; V315-S318 VanDerWaalsContact O-CB 3.31Å; V315-S318 WeakPolarHBondContact O-CB 3.01Å; V315-S318 PolarHBondContact O-N 2.8Å; V315-S318 VanDerWaalsContact O-N 3.15Å; V315-I319 HydrophobicContact CG1-CD1 4.06Å; V315-I319 HydrophobicContact CG1-CG1 4.39Å; V315-I319 WeakPolarHBondContact O-CG1 3.27Å; V315-I319 PolarHBondContact O-N 2.78Å; V315-C371 HydrophobicContact CG2-CB 3.68Å; V315-I375 HydrophobicContact CB-CG1 4.39Å; V315-I375 HydrophobicContact CG2-CD1 3.91Å; V315-I375 HydrophobicContact CG2-CG1 3.91Å; V315-F642 HydrophobicContact CB-CD1 4.41Å; V315-F642 HydrophobicContact CB-CD2 4.46Å; V315-F642 HydrophobicContact CB-CE1 3.81Å; V315-F642 HydrophobicContact CB-CE2 3.88Å; V315-F642 HydrophobicContact CB-CZ 3.51Å; V315-F642 HydrophobicContact CG1-CD1 3.7Å; V315-F642 HydrophobicContact CG1-CD2 3.7Å; V315-F642 HydrophobicContact CG1-CE1 3.61Å; V315-F642 HydrophobicContact CG1-CE2 3.63Å; V315-F642 HydrophobicContact CG1-CG 3.74Å; V315-F642 HydrophobicContact CG1-CZ 3.58Å; V315-F642 HydrophobicContact CG2-CE2 3.77Å; V315-F642 HydrophobicContact CG2-CZ 3.78Å
316	L	92.8	Very high	88.3	Confident	90 Å²	90	59.1 Å²	59.1	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-60.8	-46.1	176	-178.1	61.8	0	0	0	111.8	M312 L313 S318 I319 I320	M312-L316 PolarHBondContact O-N 2.9Å; L313-L316 PolarHBondContact O-N 3.08Å; L316-S318 VanDerWaalsContact C-N 3.3Å; L316-S318 PolarHBondContact O-N 3.41Å; L316-I319 PolarHBondContact O-N 2.82Å; L316-I320 HydrophobicContact CD1-CD1 4.33Å; L316-I320 HydrophobicContact CG-CD1 4.06Å; L316-I320 WeakPolarHBondContact O-CG1 2.83Å; L316-I320 PolarHBondContact O-N 3.38Å
317	I	93.6	Very high	87.9	Confident	83 Å²	83	54.7 Å²	54.7	43%	0.426	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-42.5	173.4	-67.4	163.3	0	0	0	110.4	L313 L314 V315 I319 I320 L321 L339	L313-I317 VanDerWaalsContact O-CG1 3.29Å; L313-I317 WeakPolarHBondContact O-CG1 3.36Å; L313-I317 PolarHBondContact O-N 3.16Å; L314-I317 PolarHBondContact O-N 3.46Å; V315-I317 PolarHBondContact O-N 3.05Å; I317-I319 VanDerWaalsContact C-N 3.3Å; I317-I319 PolarHBondContact O-N 2.89Å; I317-I320 PolarHBondContact O-N 3.17Å; I317-L321 HydrophobicContact CG2-CD1 4.04Å; I317-L321 HydrophobicContact CG2-CG 4.43Å; I317-L321 WeakPolarHBondContact O-CB 3.27Å; I317-L321 WeakPolarHBondContact O-CG 3.29Å; I317-L321 PolarHBondContact O-N 2.9Å; I317-L339 HydrophobicContact CB-CD2 4.38Å; I317-L339 HydrophobicContact CG2-CD1 4.44Å; I317-L339 HydrophobicContact CG2-CD2 4.02Å
318	S	93.4	Very high	87.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-39.1	177.2	-171.1	0	0	0	0	112.7	L314 V315 L316 L322 Q336 I378	L314-S318 WeakPolarHBondContact O-CB 3.36Å; L314-S318 PolarHBondContact O-N 3.31Å; V315-S318 VanDerWaalsContact O-CB 3.31Å; V315-S318 WeakPolarHBondContact O-CB 3.01Å; V315-S318 PolarHBondContact O-N 2.8Å; V315-S318 VanDerWaalsContact O-N 3.15Å; L316-S318 VanDerWaalsContact C-N 3.3Å; L316-S318 PolarHBondContact O-N 3.41Å; S318-L322 WeakPolarHBondContact O-CB 3.42Å; S318-L322 PolarHBondContact O-N 3.18Å; S318-Q336 VanDerWaalsContact OG-CD 3.23Å; S318-Q336 PolarHBondContact OG-NE2 3.2Å; S318-Q336 PolarHBondContact OG-OE1 2.92Å; S318-I378 WeakPolarHBondContact OG-CD1 3.01Å; S318-I378 WeakPolarHBondContact OG-CG2 3.48Å
319	I	91.4	Very high	87.3	Confident	20 Å²	20	59 Å²	59	10%	0.103	31%	0.312	C	S	.	.	H	α-helix	trans	-71.7	-42.3	177.7	-71.1	173.5	0	0	0	111.1	V315 L316 I317 L321 L322 W323 I378 T639 F642	V315-I319 HydrophobicContact CG1-CD1 4.06Å; V315-I319 HydrophobicContact CG1-CG1 4.39Å; V315-I319 WeakPolarHBondContact O-CG1 3.27Å; V315-I319 PolarHBondContact O-N 2.78Å; L316-I319 PolarHBondContact O-N 2.82Å; I317-I319 VanDerWaalsContact C-N 3.3Å; I317-I319 PolarHBondContact O-N 2.89Å; I319-L321 VanDerWaalsContact C-N 3.32Å; I319-L321 PolarHBondContact O-N 2.87Å; I319-L322 WeakPolarHBondContact O-CB 3.46Å; I319-L322 PolarHBondContact O-N 3.08Å; I319-L322 VanDerWaalsContact O-N 3.14Å; I319-W323 PolarHBondContact O-N 2.84Å; I319-W323 VanDerWaalsContact O-N 3.13Å; I319-I378 HydrophobicContact CG1-CD1 3.85Å; I319-T639 HydrophobicContact CB-CG2 4.43Å; I319-T639 HydrophobicContact CD1-CG2 4.31Å; I319-T639 HydrophobicContact CG1-CG2 4.1Å; I319-T639 HydrophobicContact CG2-CG2 3.64Å; I319-F642 HydrophobicContact CD1-CB 4.17Å; I319-F642 HydrophobicContact CD1-CD1 3.52Å; I319-F642 HydrophobicContact CD1-CE1 4.32Å; I319-F642 HydrophobicContact CD1-CG 4.1Å
320	I	91.7	Very high	86.9	Confident	96 Å²	96	58 Å²	58	49%	0.492	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-43.6	175.5	-67.1	163.6	0	0	0	110.4	L316 I317 L322 W323 T324	L316-I320 HydrophobicContact CD1-CD1 4.33Å; L316-I320 HydrophobicContact CG-CD1 4.06Å; L316-I320 WeakPolarHBondContact O-CG1 2.83Å; L316-I320 PolarHBondContact O-N 3.38Å; I317-I320 PolarHBondContact O-N 3.17Å; I320-L322 VanDerWaalsContact C-N 3.33Å; I320-L322 PolarHBondContact O-N 3.18Å; I320-W323 PolarHBondContact O-N 3.4Å; I320-T324 WeakPolarHBondContact O-CB 3.38Å; I320-T324 PolarHBondContact O-N 3.4Å; I320-T324 PolarHBondContact O-OG1 3.48Å
321	L	91.9	Very high	86.7	Confident	30 Å²	30	59.9 Å²	59.9	16%	0.157	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-40.4	173.5	-73.2	172.1	0	0	0	112.1	I317 I319 W323 T324 L327 L332 L339	I317-L321 HydrophobicContact CG2-CD1 4.04Å; I317-L321 HydrophobicContact CG2-CG 4.43Å; I317-L321 WeakPolarHBondContact O-CB 3.27Å; I317-L321 WeakPolarHBondContact O-CG 3.29Å; I317-L321 PolarHBondContact O-N 2.9Å; I319-L321 VanDerWaalsContact C-N 3.32Å; I319-L321 PolarHBondContact O-N 2.87Å; L321-W323 VanDerWaalsContact C-N 3.3Å; L321-W323 PolarHBondContact O-N 2.89Å; L321-T324 PolarHBondContact O-N 3.2Å; L321-L327 HydrophobicContact CD2-CD2 4.09Å; L321-L332 HydrophobicContact CB-CD1 3.89Å; L321-L332 HydrophobicContact CD2-CD1 4.34Å; L321-L332 WeakPolarHBondContact O-CD1 3.44Å; L321-L339 HydrophobicContact CD1-CD2 4.16Å
322	L	88.4	Confident	86.6	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-33.1	177	-179.3	62.4	0	0	0	113.1	S318 I319 I320 I378 F381 V382 K635 T639	S318-L322 WeakPolarHBondContact O-CB 3.42Å; S318-L322 PolarHBondContact O-N 3.18Å; I319-L322 WeakPolarHBondContact O-CB 3.46Å; I319-L322 PolarHBondContact O-N 3.08Å; I319-L322 VanDerWaalsContact O-N 3.14Å; I320-L322 VanDerWaalsContact C-N 3.33Å; I320-L322 PolarHBondContact O-N 3.18Å; L322-I378 HydrophobicContact CB-CG2 4.12Å; L322-I378 HydrophobicContact CD1-CG2 4.31Å; L322-I378 HydrophobicContact CD2-CG1 4.37Å; L322-I378 HydrophobicContact CD2-CG2 4.2Å; L322-I378 HydrophobicContact CG-CG2 4.44Å; L322-F381 HydrophobicContact CD1-CD1 3.5Å; L322-F381 VanDerWaalsContact CD1-CD1 3.5Å; L322-F381 HydrophobicContact CD1-CE1 3.58Å; L322-V382 HydrophobicContact CD1-CG2 4.28Å; L322-K635 HydrophobicContact CD1-CD 4.22Å; L322-K635 HydrophobicContact CD1-CG 4.11Å; L322-K635 HydrophobicContact CD2-CB 4.48Å; L322-K635 HydrophobicContact CD2-CG 4.41Å; L322-K635 HydrophobicContact CG-CD 4.17Å; L322-K635 HydrophobicContact CG-CG 4.17Å; L322-K635 WeakPolarHBondContact O-CE 3.06Å; L322-K635 PolarHBondContact O-NZ 3.34Å; L322-T639 HydrophobicContact CD2-CG2 4.31Å
323	W	87.4	Confident	86.5	Confident	120 Å²	120	58.4 Å²	58.4	46%	0.455	31%	0.306	S	S	.	.	H	α-helix	trans	-83	-22	175.2	-73.4	107.5	0	0	0	113.8	I319 I320 L321 N325 T636	I319-W323 PolarHBondContact O-N 2.84Å; I319-W323 VanDerWaalsContact O-N 3.13Å; I320-W323 PolarHBondContact O-N 3.4Å; L321-W323 VanDerWaalsContact C-N 3.3Å; L321-W323 PolarHBondContact O-N 2.89Å; W323-N325 PolarHBondContact O-N 3.25Å; W323-T636 HydrophobicContact CH2-CG2 3.63Å; W323-T636 HydrophobicContact CZ2-CG2 3.97Å
324	T	85.3	Confident	86.4	Confident	42 Å²	42	54.7 Å²	54.7	26%	0.258	29%	0.287	S	S	.	.			trans	-79.7	91.3	-174.2	-56.6	0	0	0	0	112.3	I320 L321 Q326 L327	I320-T324 WeakPolarHBondContact O-CB 3.38Å; I320-T324 PolarHBondContact O-N 3.4Å; I320-T324 PolarHBondContact O-OG1 3.48Å; L321-T324 PolarHBondContact O-N 3.2Å; T324-Q326 HydrophobicContact CG2-CB 4.23Å; T324-Q326 PolarHBondContact O-N 3.34Å; T324-Q326 VanDerWaalsContact O-N 3.15Å; T324-L327 HydrophobicContact CG2-CD1 3.55Å
325	N	70.1	Confident	86.2	Confident	139 Å²	139	55.7 Å²	55.7	74%	0.743	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-8.4	177.7	-73.3	-13.4	0	0	0	114.8	W323 K635	W323-N325 PolarHBondContact O-N 3.25Å; N325-K635 PolarHBondContact OD1-NZ 3.3Å
326	Q	65.8	Low	86.2	Confident	185 Å²	185	55.8 Å²	55.8	86%	0.864	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-19.5	-174.6	-68.8	178.6	-14.5	0	0	114.3	T324	T324-Q326 HydrophobicContact CG2-CB 4.23Å; T324-Q326 PolarHBondContact O-N 3.34Å; T324-Q326 VanDerWaalsContact O-N 3.15Å
327	L	72.7	Confident	86.2	Confident	63 Å²	63	52.9 Å²	52.9	33%	0.33	28%	0.279	S	S	.	.	S	Bend	trans	-80.5	128.3	176.6	-81.3	75.3	0	0	0	110.2	L321 T324 T329 L332	L321-L327 HydrophobicContact CD2-CD2 4.09Å; T324-L327 HydrophobicContact CG2-CD1 3.55Å; L327-T329 PolarHBondContact O-N 3.42Å; L327-L332 HydrophobicContact CB-CB 4.29Å
328	G	79.1	Confident	86.2	Confident	46 Å²	46	52.5 Å²	52.5	47%	0.474	28%	0.277	S	S	.	.			trans	-52.9	134.4	170.8	0	0	0	0	0	111.1	H330 N331 L332	G328-H330 PolarHBondContact O-N 3.41Å; G328-N331 WeakPolarHBondContact O-CB 3.45Å; G328-N331 PolarHBondContact O-N 2.99Å; G328-L332 PolarHBondContact O-N 3.18Å; G328-L332 VanDerWaalsContact O-N 3.11Å
329	T	80.8	Confident	86.3	Confident	50 Å²	50	53.3 Å²	53.3	31%	0.307	28%	0.281	S	S	.	.	H	α-helix	trans	-54.6	-36.5	-164.5	53.2	0	0	0	0	114.2	L327 S333	L327-T329 PolarHBondContact O-N 3.42Å; T329-S333 PolarHBondContact O-N 3.42Å; T329-S333 VanDerWaalsContact O-N 3.11Å; T329-S333 PolarHBondContact O-OG 3.11Å; T329-S333 VanDerWaalsContact O-OG 3.12Å
330	H	83	Confident	86.5	Confident	57 Å²	57	54.3 Å²	54.3	26%	0.264	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-46.5	174.4	169.5	-91.8	0	0	0	112.6	G328 L332 S333 C334	G328-H330 PolarHBondContact O-N 3.41Å; H330-L332 VanDerWaalsContact C-N 3.32Å; H330-L332 PolarHBondContact O-N 3.43Å; H330-S333 WeakPolarHBondContact CA-OG 3.48Å; H330-S333 PolarHBondContact O-N 2.72Å; H330-S333 PolarHBondContact O-OG 2.97Å; H330-C334 PolarHBondContact O-N 2.86Å
331	N	87.2	Confident	86.7	Confident	84 Å²	84	53.3 Å²	53.3	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-67.4	-38.6	-179	-65.1	4.3	0	0	0	110.2	G328 S333 C334 T335	G328-N331 WeakPolarHBondContact O-CB 3.45Å; G328-N331 PolarHBondContact O-N 2.99Å; N331-S333 PolarHBondContact O-N 3.18Å; N331-C334 WeakPolarHBondContact O-CB 3.48Å; N331-C334 PolarHBondContact O-N 3.47Å; N331-C334 VanDerWaalsContact O-N 3.17Å; N331-T335 PolarHBondContact O-N 2.87Å; N331-T335 PolarHBondContact O-OG1 3.09Å
332	L	89.8	Confident	86.8	Confident	19 Å²	19	57.7 Å²	57.7	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-42.1	173.5	-176.7	63.6	0	0	0	112.3	L321 L327 G328 H330 T335 Q336 V382	L321-L332 HydrophobicContact CB-CD1 3.89Å; L321-L332 HydrophobicContact CD2-CD1 4.34Å; L321-L332 WeakPolarHBondContact O-CD1 3.44Å; L327-L332 HydrophobicContact CB-CB 4.29Å; G328-L332 PolarHBondContact O-N 3.18Å; G328-L332 VanDerWaalsContact O-N 3.11Å; H330-L332 VanDerWaalsContact C-N 3.32Å; H330-L332 PolarHBondContact O-N 3.43Å; L332-T335 PolarHBondContact O-OG1 2.85Å; L332-T335 VanDerWaalsContact O-OG1 3.08Å; L332-Q336 WeakPolarHBondContact O-CB 3.37Å; L332-Q336 PolarHBondContact O-N 2.92Å; L332-V382 HydrophobicContact CD2-CG1 4.28Å; L332-V382 HydrophobicContact CD2-CG2 4.38Å; L332-V382 HydrophobicContact CG-CG1 4.02Å; L332-V382 HydrophobicContact CG-CG2 4.46Å
333	S	89.5	Confident	87.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.4	-36.5	173.1	38.3	0	0	0	0	113.1	T329 H330 N331 L337	T329-S333 PolarHBondContact O-N 3.42Å; T329-S333 VanDerWaalsContact O-N 3.11Å; T329-S333 PolarHBondContact O-OG 3.11Å; T329-S333 VanDerWaalsContact O-OG 3.12Å; H330-S333 WeakPolarHBondContact CA-OG 3.48Å; H330-S333 PolarHBondContact O-N 2.72Å; H330-S333 PolarHBondContact O-OG 2.97Å; N331-S333 PolarHBondContact O-N 3.18Å; S333-L337 WeakPolarHBondContact O-CB 3.08Å; S333-L337 PolarHBondContact O-N 3.42Å
334	C	90.9	Very high	87.4	Confident	4 Å²	4	54.4 Å²	54.4	3%	0.027	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-50.6	173.9	-88.5	0	0	0	0	112.5	H330 N331 Q336 L337 I338 C601	H330-C334 PolarHBondContact O-N 2.86Å; N331-C334 WeakPolarHBondContact O-CB 3.48Å; N331-C334 PolarHBondContact O-N 3.47Å; N331-C334 VanDerWaalsContact O-N 3.17Å; C334-Q336 VanDerWaalsContact C-N 3.28Å; C334-Q336 PolarHBondContact O-N 2.96Å; C334-L337 PolarHBondContact O-N 3.3Å; C334-I338 WeakPolarHBondContact O-CG1 3.39Å; C334-I338 PolarHBondContact O-N 3.23Å; C334-C601 WeakPolarHBondContact CB-SG 3.3Å; C334-C601 VanDerWaalsContact SG-CA 3.54Å; C334-C601 WeakPolarHBondContact SG-CB 3.35Å; C334-C601 CovalentContact SG-SG 2.04Å; C334-C601 PolarHBondContact SG-SG 3.36Å
335	T	91.9	Very high	87.8	Confident	37 Å²	37	55.8 Å²	55.8	23%	0.227	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-38.7	180	52	0	0	0	0	111.7	N331 L332 I338 L339 F597	N331-T335 PolarHBondContact O-N 2.87Å; N331-T335 PolarHBondContact O-OG1 3.09Å; L332-T335 PolarHBondContact O-OG1 2.85Å; L332-T335 VanDerWaalsContact O-OG1 3.08Å; T335-I338 PolarHBondContact O-N 2.92Å; T335-L339 WeakPolarHBondContact O-CB 3.23Å; T335-L339 PolarHBondContact O-N 3.37Å; T335-F597 HydrophobicContact CG2-CE2 4.37Å; T335-F597 HydrophobicContact CG2-CZ 4.34Å
336	Q	92.8	Very high	88.8	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-69.3	-34.2	178.4	-174.8	61.2	33.4	0	0	112.7	S318 L332 C334 F340 I375 Y379	S318-Q336 VanDerWaalsContact OG-CD 3.23Å; S318-Q336 PolarHBondContact OG-NE2 3.2Å; S318-Q336 PolarHBondContact OG-OE1 2.92Å; L332-Q336 WeakPolarHBondContact O-CB 3.37Å; L332-Q336 PolarHBondContact O-N 2.92Å; C334-Q336 VanDerWaalsContact C-N 3.28Å; C334-Q336 PolarHBondContact O-N 2.96Å; Q336-F340 PolarHBondContact O-N 3.12Å; Q336-F340 VanDerWaalsContact O-N 3.12Å; Q336-I375 PolarHBondContact NE2-O 3.01Å; Q336-Y379 HydrophobicContact CB-CD2 4.19Å; Q336-Y379 HydrophobicContact CG-CD2 3.86Å; Q336-Y379 HydrophobicContact CG-CG 4.28Å
337	L	93.7	Very high	90	Very high	30 Å²	30	44.5 Å²	44.5	16%	0.157	24%	0.241	C	C	.	.	H	α-helix	trans	-66.2	-45.4	171.4	175	57.7	0	0	0	111.8	S333 C334 L339 F340 L341 Y379	S333-L337 WeakPolarHBondContact O-CB 3.08Å; S333-L337 PolarHBondContact O-N 3.42Å; C334-L337 PolarHBondContact O-N 3.3Å; L337-L339 VanDerWaalsContact C-N 3.28Å; L337-L339 PolarHBondContact O-N 3.16Å; L337-F340 WeakPolarHBondContact O-CB 3.13Å; L337-F340 PolarHBondContact O-N 3.18Å; L337-L341 HydrophobicContact CD1-CD1 4.25Å; L337-L341 HydrophobicContact CD1-CG 4.22Å; L337-L341 HydrophobicContact CG-CD1 4.19Å; L337-L341 WeakPolarHBondContact O-CG 3.45Å; L337-L341 PolarHBondContact O-N 2.87Å; L337-Y379 HydrophobicContact CB-CD2 4.38Å; L337-Y379 HydrophobicContact CB-CE2 3.7Å; L337-Y379 HydrophobicContact CD1-CE1 4.06Å; L337-Y379 HydrophobicContact CD1-CE2 4.45Å
338	I	94.4	Very high	90.8	Very high	75 Å²	75	46 Å²	46	39%	0.385	25%	0.249	S	C	.	.	H	α-helix	trans	-60.8	-41.2	178.6	-68.1	162.8	0	0	0	110.5	C334 T335 L341 F342 F597	C334-I338 WeakPolarHBondContact O-CG1 3.39Å; C334-I338 PolarHBondContact O-N 3.23Å; T335-I338 PolarHBondContact O-N 2.92Å; I338-L341 PolarHBondContact O-N 3.03Å; I338-F342 WeakPolarHBondContact O-CB 3.22Å; I338-F342 PolarHBondContact O-N 3.41Å; I338-F597 HydrophobicContact CD1-CD2 3.44Å; I338-F597 VanDerWaalsContact CD1-CD2 3.44Å; I338-F597 HydrophobicContact CD1-CE2 3.45Å; I338-F597 VanDerWaalsContact CD1-CE2 3.45Å
339	L	94.4	Very high	91.3	Very high	17 Å²	17	49.9 Å²	49.9	9%	0.089	25%	0.249	C	C	.	.	H	α-helix	trans	-64.7	-37.8	177.3	-169.8	59.6	0	0	0	112.7	L314 I317 L321 T335 L337 S343 I375	L314-L339 HydrophobicContact CB-CD1 4.02Å; L314-L339 HydrophobicContact CD2-CD1 3.78Å; L314-L339 HydrophobicContact CG-CD1 4.45Å; I317-L339 HydrophobicContact CB-CD2 4.38Å; I317-L339 HydrophobicContact CG2-CD1 4.44Å; I317-L339 HydrophobicContact CG2-CD2 4.02Å; L321-L339 HydrophobicContact CD1-CD2 4.16Å; T335-L339 WeakPolarHBondContact O-CB 3.23Å; T335-L339 PolarHBondContact O-N 3.37Å; L337-L339 VanDerWaalsContact C-N 3.28Å; L337-L339 PolarHBondContact O-N 3.16Å; L339-S343 PolarHBondContact O-N 3.34Å; L339-I375 HydrophobicContact CG-CG2 4.4Å
340	F	95.3	Very high	91.4	Very high	41 Å²	41	48.4 Å²	48.4	18%	0.18	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-46.1	172.7	178.9	-123.5	0	0	0	112.3	Q336 L337 F342 S343 I344 I375 C376	Q336-F340 PolarHBondContact O-N 3.12Å; Q336-F340 VanDerWaalsContact O-N 3.12Å; L337-F340 WeakPolarHBondContact O-CB 3.13Å; L337-F340 PolarHBondContact O-N 3.18Å; F340-F342 PolarHBondContact O-N 2.89Å; F340-S343 WeakPolarHBondContact O-CB 3.29Å; F340-S343 PolarHBondContact O-N 2.83Å; F340-I344 HydrophobicContact CD1-CD1 4.28Å; F340-I344 HydrophobicContact CD2-CD1 4.35Å; F340-I344 HydrophobicContact CE1-CD1 3.77Å; F340-I344 HydrophobicContact CE2-CD1 3.83Å; F340-I344 HydrophobicContact CE2-CG1 4.32Å; F340-I344 HydrophobicContact CZ-CD1 3.54Å; F340-I344 HydrophobicContact CZ-CG1 4.49Å; F340-I344 PolarHBondContact O-N 3.07Å; F340-I344 VanDerWaalsContact O-N 3.11Å; F340-I375 HydrophobicContact CB-CG2 3.84Å; F340-I375 HydrophobicContact CD2-CG2 4.27Å; F340-C376 HydrophobicContact CD2-CB 4.09Å; F340-C376 HydrophobicContact CE2-CB 3.57Å; F340-C376 HydrophobicContact CZ-CB 4.04Å
341	L	95.8	Very high	91.4	Very high	75 Å²	75	47.7 Å²	47.7	39%	0.393	24%	0.237	S	C	.	.	H	α-helix	trans	-60.4	-45.2	176.3	-69.2	170.8	0	0	0	111.3	L337 I338 S343 I344 S345	L337-L341 HydrophobicContact CD1-CD1 4.25Å; L337-L341 HydrophobicContact CD1-CG 4.22Å; L337-L341 HydrophobicContact CG-CD1 4.19Å; L337-L341 WeakPolarHBondContact O-CG 3.45Å; L337-L341 PolarHBondContact O-N 2.87Å; I338-L341 PolarHBondContact O-N 3.03Å; L341-S343 VanDerWaalsContact C-N 3.33Å; L341-S343 PolarHBondContact O-N 3Å; L341-I344 PolarHBondContact O-N 3.37Å; L341-I344 VanDerWaalsContact O-N 3.16Å; L341-S345 PolarHBondContact O-N 3.05Å; L341-S345 PolarHBondContact O-OG 2.8Å
342	F	95.6	Very high	91.1	Very high	122 Å²	122	49.9 Å²	49.9	54%	0.535	24%	0.244	S	C	.	.	H	α-helix	trans	-63.7	-36.5	177.8	-170.7	-94.3	0	0	0	112.6	L314 I338 F340 I344 S345 F346	L314-F342 HydrophobicContact CD1-CD1 3.65Å; L314-F342 HydrophobicContact CD1-CE1 4.12Å; L314-F342 HydrophobicContact CD2-CD1 3.58Å; L314-F342 HydrophobicContact CD2-CE1 3.83Å; L314-F342 HydrophobicContact CG-CD1 4.26Å; I338-F342 WeakPolarHBondContact O-CB 3.22Å; I338-F342 PolarHBondContact O-N 3.41Å; F340-F342 PolarHBondContact O-N 2.89Å; F342-I344 PolarHBondContact O-N 2.04Å; F342-S345 PolarHBondContact O-N 2.8Å; F342-F346 WeakPolarHBondContact O-CB 3.07Å; F342-F346 PolarHBondContact O-N 2.72Å
343	S	93.8	Very high	90.3	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-61.5	-41.2	172.5	-169.1	0	0	0	0	112.3	L339 F340 L341 W347 S372	L339-S343 PolarHBondContact O-N 3.34Å; F340-S343 WeakPolarHBondContact O-CB 3.29Å; F340-S343 PolarHBondContact O-N 2.83Å; L341-S343 VanDerWaalsContact C-N 3.33Å; L341-S343 PolarHBondContact O-N 3Å; S343-W347 WeakPolarHBondContact O-CB 3.11Å; S343-W347 PolarHBondContact O-N 3.04Å; S343-S372 PolarHBondContact OG-OG 2.86Å
344	I	93.7	Very high	89.1	Confident	54 Å²	54	56.3 Å²	56.3	28%	0.277	28%	0.275	S	S	.	.	H	α-helix	trans	-68.2	-44.7	175.4	-67.2	169.3	0	0	0	110.9	F340 L341 F342 F346 W347 L348	F340-I344 HydrophobicContact CD1-CD1 4.28Å; F340-I344 HydrophobicContact CD2-CD1 4.35Å; F340-I344 HydrophobicContact CE1-CD1 3.77Å; F340-I344 HydrophobicContact CE2-CD1 3.83Å; F340-I344 HydrophobicContact CE2-CG1 4.32Å; F340-I344 HydrophobicContact CZ-CD1 3.54Å; F340-I344 HydrophobicContact CZ-CG1 4.49Å; F340-I344 PolarHBondContact O-N 3.07Å; F340-I344 VanDerWaalsContact O-N 3.11Å; L341-I344 PolarHBondContact O-N 3.37Å; L341-I344 VanDerWaalsContact O-N 3.16Å; F342-I344 PolarHBondContact O-N 2.04Å; I344-F346 VanDerWaalsContact C-N 3.33Å; I344-F346 PolarHBondContact O-N 3.4Å; I344-W347 PolarHBondContact O-N 3.08Å; I344-L348 HydrophobicContact CG2-CD1 3.99Å; I344-L348 HydrophobicContact CG2-CG 4.3Å; I344-L348 WeakPolarHBondContact O-CG 3.29Å; I344-L348 PolarHBondContact O-N 2.91Å
345	S	93.2	Very high	87.1	Confident	72 Å²	72	62.5 Å²	62.5	50%	0.503	31%	0.307	S	S	.	.	H	α-helix	trans	-59.9	-42.4	176.9	-63	0	0	0	0	112.2	L341 F342 L348 W349	L341-S345 PolarHBondContact O-N 3.05Å; L341-S345 PolarHBondContact O-OG 2.8Å; F342-S345 PolarHBondContact O-N 2.8Å; S345-L348 PolarHBondContact O-N 2.7Å; S345-W349 WeakPolarHBondContact O-CB 3.45Å; S345-W349 PolarHBondContact O-N 2.85Å
346	F	91.8	Very high	85.3	Confident	26 Å²	26	65.3 Å²	65.3	11%	0.114	32%	0.321	C	S	.	.	H	α-helix	trans	-63.9	-42.9	173.9	178.9	-93.8	0	0	0	112.1	P310 P311 F342 I344 W349 M350	P310-F346 HydrophobicContact CB-CD2 4.29Å; P310-F346 HydrophobicContact CB-CE1 4.24Å; P310-F346 HydrophobicContact CB-CE2 3.71Å; P310-F346 HydrophobicContact CB-CZ 3.68Å; P310-F346 HydrophobicContact CG-CE2 3.91Å; P310-F346 HydrophobicContact CG-CZ 3.78Å; P311-F346 HydrophobicContact CB-CD1 4.42Å; P311-F346 HydrophobicContact CB-CE1 4.46Å; P311-F346 HydrophobicContact CG-CD1 4.42Å; P311-F346 HydrophobicContact CG-CE1 3.98Å; F342-F346 WeakPolarHBondContact O-CB 3.07Å; F342-F346 PolarHBondContact O-N 2.72Å; I344-F346 VanDerWaalsContact C-N 3.33Å; I344-F346 PolarHBondContact O-N 3.4Å; F346-W349 HydrophobicContact CD2-CE3 4.32Å; F346-W349 HydrophobicContact CE2-CE3 4.13Å; F346-W349 HydrophobicContact CE2-CZ3 4.13Å; F346-W349 PolarHBondContact O-N 2.92Å; F346-M350 HydrophobicContact CD1-CG 3.98Å; F346-M350 HydrophobicContact CD2-CG 4.42Å; F346-M350 HydrophobicContact CE1-CG 3.38Å; F346-M350 HydrophobicContact CE1-SD 4.34Å; F346-M350 HydrophobicContact CE2-CG 3.91Å; F346-M350 HydrophobicContact CE2-SD 4.18Å; F346-M350 HydrophobicContact CG-CG 4.46Å; F346-M350 HydrophobicContact CZ-CG 3.34Å; F346-M350 HydrophobicContact CZ-SD 3.74Å; F346-M350 WeakPolarHBondContact O-CB 3.22Å; F346-M350 WeakPolarHBondContact O-CG 3.02Å; F346-M350 PolarHBondContact O-N 2.98Å
347	W	90.8	Very high	83.5	Confident	61 Å²	61	66.2 Å²	66.2	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-62	-43.4	177	178.8	31.5	0	0	0	112.2	S343 I344 M350 N351 N365 C368 L369	S343-W347 WeakPolarHBondContact O-CB 3.11Å; S343-W347 PolarHBondContact O-N 3.04Å; I344-W347 PolarHBondContact O-N 3.08Å; W347-M350 PolarHBondContact O-N 2.91Å; W347-N351 VanDerWaalsContact CD1-ND2 3.34Å; W347-N351 PolarHBondContact NE1-ND2 2.86Å; W347-N351 VanDerWaalsContact NE1-ND2 3.18Å; W347-N351 PolarHBondContact O-N 2.89Å; W347-N351 PolarHBondContact O-ND2 2.88Å; W347-N351 VanDerWaalsContact O-ND2 3.16Å; W347-N365 WeakPolarHBondContact CZ2-OD1 3.48Å; W347-N365 PolarHBondContact NE1-OD1 2.79Å; W347-C368 HydrophobicContact CB-CB 4.07Å; W347-C368 HydrophobicContact CG-CB 3.72Å; W347-L369 HydrophobicContact CH2-CD1 4.17Å; W347-L369 HydrophobicContact CH2-CG 4.47Å; W347-L369 HydrophobicContact CZ2-CB 4.2Å; W347-L369 HydrophobicContact CZ2-CD1 4.17Å
348	L	90	Very high	81.5	Confident	95 Å²	95	68.2 Å²	68.2	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-47.6	175.3	-70.2	173.4	0	0	0	111.6	I344 S345 M350 N351 E352	I344-L348 HydrophobicContact CG2-CD1 3.99Å; I344-L348 HydrophobicContact CG2-CG 4.3Å; I344-L348 WeakPolarHBondContact O-CG 3.29Å; I344-L348 PolarHBondContact O-N 2.91Å; S345-L348 PolarHBondContact O-N 2.7Å; L348-M350 VanDerWaalsContact C-N 3.34Å; L348-M350 PolarHBondContact O-N 2.86Å; L348-N351 WeakPolarHBondContact O-CB 3.48Å; L348-N351 PolarHBondContact O-N 2.62Å; L348-N351 VanDerWaalsContact O-N 3.08Å; L348-E352 PolarHBondContact O-N 3.23Å
349	W	88.7	Confident	79.6	Confident	126 Å²	126	71.1 Å²	71.1	48%	0.477	35%	0.352	S	S	.	.	H	α-helix	trans	-60.1	-41.3	176.1	179.9	76.3	0	0	0	112.6	S345 F346 N351 E352 Q353	S345-W349 WeakPolarHBondContact O-CB 3.45Å; S345-W349 PolarHBondContact O-N 2.85Å; F346-W349 HydrophobicContact CD2-CE3 4.32Å; F346-W349 HydrophobicContact CE2-CE3 4.13Å; F346-W349 HydrophobicContact CE2-CZ3 4.13Å; F346-W349 PolarHBondContact O-N 2.92Å; W349-N351 VanDerWaalsContact C-N 3.31Å; W349-N351 PolarHBondContact O-N 2.04Å; W349-E352 PolarHBondContact O-N 2.56Å; W349-Q353 HydrophobicContact CD2-CG 4.33Å; W349-Q353 HydrophobicContact CH2-CG 4.5Å; W349-Q353 HydrophobicContact CZ2-CG 4.12Å; W349-Q353 WeakPolarHBondContact O-CG 3.41Å; W349-Q353 PolarHBondContact O-N 2.84Å
350	M	84.1	Confident	77.7	Confident	20 Å²	20	72.2 Å²	72.2	10%	0.099	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-33.8	174.2	-75.3	-59.7	-68.3	0	0	112.6	F346 W347 L348 N354 L364	F346-M350 HydrophobicContact CD1-CG 3.98Å; F346-M350 HydrophobicContact CD2-CG 4.42Å; F346-M350 HydrophobicContact CE1-CG 3.38Å; F346-M350 HydrophobicContact CE1-SD 4.34Å; F346-M350 HydrophobicContact CE2-CG 3.91Å; F346-M350 HydrophobicContact CE2-SD 4.18Å; F346-M350 HydrophobicContact CG-CG 4.46Å; F346-M350 HydrophobicContact CZ-CG 3.34Å; F346-M350 HydrophobicContact CZ-SD 3.74Å; F346-M350 WeakPolarHBondContact O-CB 3.22Å; F346-M350 WeakPolarHBondContact O-CG 3.02Å; F346-M350 PolarHBondContact O-N 2.98Å; W347-M350 PolarHBondContact O-N 2.91Å; L348-M350 VanDerWaalsContact C-N 3.34Å; L348-M350 PolarHBondContact O-N 2.86Å; M350-N354 VanDerWaalsContact O-CB 3.32Å; M350-N354 WeakPolarHBondContact O-CB 3.39Å; M350-N354 PolarHBondContact O-N 3.08Å; M350-N354 VanDerWaalsContact O-N 3.16Å; M350-N354 PolarHBondContact O-ND2 2.79Å; M350-L364 HydrophobicContact CE-CD2 3.53Å; M350-L364 HydrophobicContact CE-CG 4.44Å
351	N	81.9	Confident	76	Confident	42 Å²	42	71.1 Å²	71.1	23%	0.225	36%	0.355	C	S	.	.	H	α-helix	trans	-69	-41.4	173.8	-68.9	-29.7	0	0	0	111.2	W347 L348 W349 N354 L355	W347-N351 VanDerWaalsContact CD1-ND2 3.34Å; W347-N351 PolarHBondContact NE1-ND2 2.86Å; W347-N351 VanDerWaalsContact NE1-ND2 3.18Å; W347-N351 PolarHBondContact O-N 2.89Å; W347-N351 PolarHBondContact O-ND2 2.88Å; W347-N351 VanDerWaalsContact O-ND2 3.16Å; L348-N351 WeakPolarHBondContact O-CB 3.48Å; L348-N351 PolarHBondContact O-N 2.62Å; L348-N351 VanDerWaalsContact O-N 3.08Å; W349-N351 VanDerWaalsContact C-N 3.31Å; W349-N351 PolarHBondContact O-N 2.04Å; N351-N354 CarbonylContact O-C 3.27Å; N351-N354 VanDerWaalsContact O-C 3.27Å; N351-N354 PolarHBondContact O-N 2.98Å; N351-L355 PolarHBondContact O-N 2.03Å
352	E	80.8	Confident	74.9	Confident	129 Å²	129	68.9 Å²	68.9	60%	0.603	35%	0.35	S	S	*	.	H	α-helix	trans	-57	-49.9	174.2	-72.4	173.1	173.9	0	0	111.5	L348 W349 N354 L355	L348-E352 PolarHBondContact O-N 3.23Å; W349-E352 PolarHBondContact O-N 2.56Å; E352-N354 PolarHBondContact O-N 3.22Å; E352-L355 WeakPolarHBondContact O-CG 3.38Å; E352-L355 PolarHBondContact O-N 2.93Å
353	Q	73.5	Confident	73.9	Confident	122 Å²	122	65.6 Å²	65.6	57%	0.57	34%	0.336	S	S	*	.	H	α-helix	trans	-64.3	-19.1	176	-61.9	-72.2	11.9	0	0	113.5	W349	W349-Q353 HydrophobicContact CD2-CG 4.33Å; W349-Q353 HydrophobicContact CH2-CG 4.5Å; W349-Q353 HydrophobicContact CZ2-CG 4.12Å; W349-Q353 WeakPolarHBondContact O-CG 3.41Å; W349-Q353 PolarHBondContact O-N 2.84Å
354	N	64.7	Low	73.3	Confident	33 Å²	33	66.2 Å²	66.2	18%	0.176	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	15.5	-178.8	-72.8	-79.8	0	0	0	114.3	M350 N351 E352 N356 N357	M350-N354 VanDerWaalsContact O-CB 3.32Å; M350-N354 WeakPolarHBondContact O-CB 3.39Å; M350-N354 PolarHBondContact O-N 3.08Å; M350-N354 VanDerWaalsContact O-N 3.16Å; M350-N354 PolarHBondContact O-ND2 2.79Å; N351-N354 CarbonylContact O-C 3.27Å; N351-N354 VanDerWaalsContact O-C 3.27Å; N351-N354 PolarHBondContact O-N 2.98Å; E352-N354 PolarHBondContact O-N 3.22Å; N354-N356 PolarHBondContact O-N 2.86Å; N354-N357 HydrophobicContact CB-CB 4.5Å; N354-N357 PolarHBondContact O-N 3.28Å; N354-N357 PolarHBondContact OD1-ND2 3.34Å
355	L	49.1	Very low	72.9	Confident	134 Å²	134	66.3 Å²	66.3	70%	0.702	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-25.7	175.3	-81.1	167.8	0	0	0	112.9	N351 E352	N351-L355 PolarHBondContact O-N 2.03Å; E352-L355 WeakPolarHBondContact O-CG 3.38Å; E352-L355 PolarHBondContact O-N 2.93Å
356	N	54	Low	72.6	Confident	95 Å²	95	67 Å²	67	51%	0.508	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	1.4	-177.3	-71.7	-14.6	0	0	0	114.9	Y83 N354	Y83-N356 WeakPolarHBondContact CB-O 3.46Å; Y83-N356 HydrophobicContact CD1-CB 4.32Å; Y83-N356 WeakPolarHBondContact CD1-O 3.46Å; Y83-N356 WeakPolarHBondContact CD2-O 3.38Å; Y83-N356 HydrophobicContact CG-CB 4.19Å; N354-N356 PolarHBondContact O-N 2.86Å
357	N	53.7	Low	72.4	Confident	21 Å²	21	66 Å²	66	11%	0.112	34%	0.337	C	S	.	.			trans	-117.3	54.8	-170.8	-68.3	-34.9	0	0	0	112.7	N354 K359 L360 S361	N354-N357 HydrophobicContact CB-CB 4.5Å; N354-N357 PolarHBondContact O-N 3.28Å; N354-N357 PolarHBondContact OD1-ND2 3.34Å; N357-K359 VanDerWaalsContact C-N 3.28Å; N357-K359 PolarHBondContact O-N 3.26Å; N357-L360 PolarHBondContact O-N 2.9Å; N357-S361 WeakPolarHBondContact O-CB 3.44Å; N357-S361 PolarHBondContact O-N 2.71Å
358	S	51.7	Low	72.4	Confident	72 Å²	72	63.2 Å²	63.2	50%	0.503	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.8	-159.6	67.1	0	0	0	0	118	Y83	Y83-S358 WeakPolarHBondContact OH-CB 3.33Å; Y83-S358 PolarHBondContact OH-OG 3.21Å
359	K	55	Low	72.5	Confident	135 Å²	135	62.7 Å²	62.7	59%	0.587	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-47.2	173.5	-54.6	-156.8	-168.2	83.6	0	113.3	E224 N357 S361 G362	E224-K359 WeakPolarHBondContact OE2-CD 3.39Å; E224-K359 IonicContact OE2-NZ 3.88Å; E224-K359 PolarHBondContact OE2-NZ 2.98Å; N357-K359 VanDerWaalsContact C-N 3.28Å; N357-K359 PolarHBondContact O-N 3.26Å; K359-S361 PolarHBondContact O-N 3.27Å; K359-G362 PolarHBondContact O-N 2.67Å
360	L	54.3	Low	72.6	Confident	41 Å²	41	59.5 Å²	59.5	22%	0.215	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-37.9	-178.1	-176.4	62.4	0	0	0	112.9	Q300 I304 N357 G362 F363	Q300-L360 HydrophobicContact CB-CD1 4.38Å; Q300-L360 HydrophobicContact CB-CD2 4.02Å; Q300-L360 VanDerWaalsContact CD-CD1 3.47Å; Q300-L360 HydrophobicContact CG-CD1 4.28Å; Q300-L360 HydrophobicContact CG-CD2 3.6Å; I304-L360 HydrophobicContact CD1-CD1 4.16Å; N357-L360 PolarHBondContact O-N 2.9Å; L360-G362 PolarHBondContact O-N 3.49Å; L360-G362 VanDerWaalsContact O-N 3.11Å; L360-F363 PolarHBondContact O-N 2.83Å
361	S	60.7	Low	73	Confident	17 Å²	17	58.6 Å²	58.6	12%	0.119	31%	0.31	C	S	.	.	H	α-helix	trans	-52.5	-34.3	175.4	-175.1	0	0	0	0	111.1	N357 K359 F363 L364 N365	N357-S361 WeakPolarHBondContact O-CB 3.44Å; N357-S361 PolarHBondContact O-N 2.71Å; K359-S361 PolarHBondContact O-N 3.27Å; S361-F363 VanDerWaalsContact C-N 3.32Å; S361-F363 PolarHBondContact O-N 2.92Å; S361-L364 PolarHBondContact O-N 3.23Å; S361-N365 WeakPolarHBondContact O-CB 3.34Å; S361-N365 PolarHBondContact O-N 2.85Å
362	G	70.9	Confident	73.5	Confident	29 Å²	29	56.9 Å²	56.9	30%	0.299	30%	0.302	S	S	.	.	H	α-helix	trans	-50.1	-42.6	178.4	0	0	0	0	0	114.8	K359 L360 V366	K359-G362 PolarHBondContact O-N 2.67Å; L360-G362 PolarHBondContact O-N 3.49Å; L360-G362 VanDerWaalsContact O-N 3.11Å; G362-V366 WeakPolarHBondContact O-CB 3.38Å; G362-V366 WeakPolarHBondContact O-CG2 3.37Å; G362-V366 PolarHBondContact O-N 3.47Å
363	F	75.5	Confident	74.1	Confident	53 Å²	53	53.4 Å²	53.4	23%	0.232	29%	0.292	C	S	.	.	H	α-helix	trans	-70	-41.3	-178.3	-176.9	-101.7	0	0	0	112.6	I231 I304 L360 S361 W367 Y649 I653	I231-F363 HydrophobicContact CD1-CD1 3.94Å; I231-F363 HydrophobicContact CD1-CE1 3.62Å; I231-F363 HydrophobicContact CD1-CE2 4.34Å; I231-F363 HydrophobicContact CD1-CG 4.42Å; I231-F363 HydrophobicContact CD1-CZ 3.84Å; I304-F363 HydrophobicContact CD1-CD1 4.43Å; I304-F363 HydrophobicContact CG2-CD1 4.3Å; I304-F363 HydrophobicContact CG2-CE1 4.17Å; L360-F363 PolarHBondContact O-N 2.83Å; S361-F363 VanDerWaalsContact C-N 3.32Å; S361-F363 PolarHBondContact O-N 2.92Å; F363-W367 PolarHBondContact O-N 2.89Å; F363-W367 VanDerWaalsContact O-N 3.16Å; F363-Y649 AromaticContact CD1-CE2 4Å; F363-Y649 HydrophobicContact CD1-CE2 4Å; F363-Y649 HydrophobicContact CE1-CD2 4.1Å; F363-Y649 AromaticContact CE1-CE2 3.24Å; F363-Y649 HydrophobicContact CE1-CE2 3.24Å; F363-Y649 AromaticContact CE1-CZ 3.65Å; F363-Y649 HydrophobicContact CE2-CD2 4.24Å; F363-Y649 AromaticContact CE2-CE2 3.99Å; F363-Y649 HydrophobicContact CE2-CE2 3.99Å; F363-Y649 AromaticContact CZ-CD2 3.63Å; F363-Y649 HydrophobicContact CZ-CD2 3.63Å; F363-Y649 AromaticContact CZ-CE2 3.24Å; F363-Y649 HydrophobicContact CZ-CE2 3.24Å; F363-I653 HydrophobicContact CE1-CD1 4.13Å; F363-I653 HydrophobicContact CE1-CG1 3.67Å; F363-I653 HydrophobicContact CZ-CG1 3.9Å
364	L	81.9	Confident	75	Confident	14 Å²	14	48.4 Å²	48.4	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-76	-34.5	178.7	-173.2	58	0	0	0	112	M350 S361 W367 C368	M350-L364 HydrophobicContact CE-CD2 3.53Å; M350-L364 HydrophobicContact CE-CG 4.44Å; S361-L364 PolarHBondContact O-N 3.23Å; L364-W367 WeakPolarHBondContact O-CB 3.34Å; L364-W367 PolarHBondContact O-N 2.86Å; L364-C368 PolarHBondContact O-N 2.9Å; L364-C368 PolarHBondContact O-SG 2.77Å
365	N	84.7	Confident	76.4	Confident	55 Å²	55	46.8 Å²	46.8	29%	0.294	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-47.5	171.4	-178.9	14.7	0	0	0	111	W347 S361 W367 C368 L369	W347-N365 WeakPolarHBondContact CZ2-OD1 3.48Å; W347-N365 PolarHBondContact NE1-OD1 2.79Å; S361-N365 WeakPolarHBondContact O-CB 3.34Å; S361-N365 PolarHBondContact O-N 2.85Å; N365-W367 VanDerWaalsContact C-N 3.33Å; N365-W367 PolarHBondContact O-N 2.89Å; N365-C368 PolarHBondContact O-N 3.34Å; N365-L369 WeakPolarHBondContact O-CB 3.43Å; N365-L369 PolarHBondContact O-N 2.82Å
366	V	85.8	Confident	78.5	Confident	87 Å²	87	42.2 Å²	42.2	53%	0.527	24%	0.24	S	C	.	.	H	α-helix	trans	-58.8	-41.8	173.4	165.2	0	0	0	0	111.5	G362 L369 M370	G362-V366 WeakPolarHBondContact O-CB 3.38Å; G362-V366 WeakPolarHBondContact O-CG2 3.37Å; G362-V366 PolarHBondContact O-N 3.47Å; V366-L369 PolarHBondContact O-N 2.85Å; V366-M370 HydrophobicContact CG1-CG 4.45Å; V366-M370 WeakPolarHBondContact O-CB 3.42Å; V366-M370 VanDerWaalsContact O-CG 3.31Å; V366-M370 WeakPolarHBondContact O-CG 3.46Å; V366-M370 PolarHBondContact O-N 3.05Å
367	W	89.5	Confident	80.4	Confident	6 Å²	6	42.3 Å²	42.3	2%	0.023	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-46.2	174.7	179.5	-117.3	0	0	0	113.1	S308 M312 F363 L364 N365 L369 M370 C371 Y649	S308-W367 PolarHBondContact O-NE1 3.16Å; M312-W367 HydrophobicContact CB-CZ2 4.21Å; F363-W367 PolarHBondContact O-N 2.89Å; F363-W367 VanDerWaalsContact O-N 3.16Å; L364-W367 WeakPolarHBondContact O-CB 3.34Å; L364-W367 PolarHBondContact O-N 2.86Å; N365-W367 VanDerWaalsContact C-N 3.33Å; N365-W367 PolarHBondContact O-N 2.89Å; W367-L369 VanDerWaalsContact C-N 3.3Å; W367-L369 PolarHBondContact O-N 2.94Å; W367-M370 PolarHBondContact O-N 3.4Å; W367-C371 VanDerWaalsContact CE2-SG 3.53Å; W367-C371 PolarHBondContact O-N 3.42Å; W367-C371 PolarHBondContact O-SG 3.41Å; W367-Y649 HydrophobicContact CB-CD2 4.32Å; W367-Y649 HydrophobicContact CB-CE1 4.31Å; W367-Y649 HydrophobicContact CB-CE2 3.55Å; W367-Y649 AromaticContact CD1-CE1 3.96Å; W367-Y649 AromaticContact CD1-CZ 3.89Å; W367-Y649 AromaticContact CD2-CD1 3.54Å; W367-Y649 HydrophobicContact CD2-CD1 3.54Å; W367-Y649 HydrophobicContact CD2-CD2 4.04Å; W367-Y649 AromaticContact CD2-CE1 3.38Å; W367-Y649 HydrophobicContact CD2-CE1 3.38Å; W367-Y649 AromaticContact CD2-CE2 3.9Å; W367-Y649 HydrophobicContact CD2-CE2 3.9Å; W367-Y649 AromaticContact CD2-CG 3.85Å; W367-Y649 HydrophobicContact CD2-CG 3.85Å; W367-Y649 AromaticContact CD2-CZ 3.57Å; W367-Y649 AromaticContact CE2-CD1 3.77Å; W367-Y649 AromaticContact CE2-CE1 3.58Å; W367-Y649 AromaticContact CE3-CD1 3.4Å; W367-Y649 HydrophobicContact CE3-CD1 3.4Å; W367-Y649 AromaticContact CE3-CD2 3.56Å; W367-Y649 HydrophobicContact CE3-CD2 3.56Å; W367-Y649 AromaticContact CE3-CE1 3.75Å; W367-Y649 HydrophobicContact CE3-CE1 3.75Å; W367-Y649 AromaticContact CE3-CE2 3.91Å; W367-Y649 HydrophobicContact CE3-CE2 3.91Å; W367-Y649 AromaticContact CE3-CG 3.27Å; W367-Y649 HydrophobicContact CE3-CG 3.27Å; W367-Y649 AromaticContact CE3-CZ 3.99Å; W367-Y649 HydrophobicContact CG-CD1 4.26Å; W367-Y649 HydrophobicContact CG-CD2 4.38Å; W367-Y649 AromaticContact CG-CE1 3.64Å; W367-Y649 HydrophobicContact CG-CE1 3.64Å; W367-Y649 AromaticContact CG-CE2 3.79Å; W367-Y649 HydrophobicContact CG-CE2 3.79Å; W367-Y649 AromaticContact CG-CZ 3.36Å; W367-Y649 AromaticContact CH2-CD1 3.76Å; W367-Y649 HydrophobicContact CH2-CD1 3.76Å; W367-Y649 HydrophobicContact CH2-CE1 4.41Å; W367-Y649 HydrophobicContact CH2-CG 4.17Å; W367-Y649 AromaticContact CZ2-CD1 3.88Å; W367-Y649 HydrophobicContact CZ2-CD1 3.88Å; W367-Y649 HydrophobicContact CZ2-CE1 4.1Å; W367-Y649 VanDerWaalsContact CZ3-CB 3.48Å; W367-Y649 AromaticContact CZ3-CD1 3.52Å; W367-Y649 HydrophobicContact CZ3-CD1 3.52Å; W367-Y649 HydrophobicContact CZ3-CD2 4.19Å; W367-Y649 HydrophobicContact CZ3-CE1 4.26Å; W367-Y649 AromaticContact CZ3-CG 3.46Å; W367-Y649 HydrophobicContact CZ3-CG 3.46Å; W367-Y649 VanDerWaalsContact CZ3-CG 3.46Å; W367-Y649 AromaticContact NE1-CE1 3.92Å
368	C	90.7	Very high	82.2	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-37.2	178	-65.3	0	0	0	0	111.9	W347 L364 N365 S372	W347-C368 HydrophobicContact CB-CB 4.07Å; W347-C368 HydrophobicContact CG-CB 3.72Å; L364-C368 PolarHBondContact O-N 2.9Å; L364-C368 PolarHBondContact O-SG 2.77Å; N365-C368 PolarHBondContact O-N 3.34Å; C368-S372 VanDerWaalsContact O-CB 3.27Å; C368-S372 WeakPolarHBondContact O-CB 3.29Å; C368-S372 PolarHBondContact O-N 3.26Å; C368-S372 PolarHBondContact O-OG 2.92Å
369	L	90.6	Very high	84.2	Confident	84 Å²	84	39.4 Å²	39.4	44%	0.44	22%	0.217	S	C	.	.	H	α-helix	trans	-66.1	-43.8	173.2	-174.2	154	0	0	0	111.5	W347 N365 V366 W367 S372 S373	W347-L369 HydrophobicContact CH2-CD1 4.17Å; W347-L369 HydrophobicContact CH2-CG 4.47Å; W347-L369 HydrophobicContact CZ2-CB 4.2Å; W347-L369 HydrophobicContact CZ2-CD1 4.17Å; N365-L369 WeakPolarHBondContact O-CB 3.43Å; N365-L369 PolarHBondContact O-N 2.82Å; V366-L369 PolarHBondContact O-N 2.85Å; W367-L369 VanDerWaalsContact C-N 3.3Å; W367-L369 PolarHBondContact O-N 2.94Å; L369-S372 PolarHBondContact O-N 2.88Å; L369-S373 WeakPolarHBondContact O-CB 3.49Å; L369-S373 PolarHBondContact O-N 2.71Å
370	M	90.8	Very high	85.9	Confident	59 Å²	59	37 Å²	37	29%	0.291	21%	0.21	S	C	.	.	H	α-helix	trans	-63.2	-41.5	176	-75.2	-57.8	-51.2	0	0	112.5	V366 W367 S374 M645	V366-M370 HydrophobicContact CG1-CG 4.45Å; V366-M370 WeakPolarHBondContact O-CB 3.42Å; V366-M370 VanDerWaalsContact O-CG 3.31Å; V366-M370 WeakPolarHBondContact O-CG 3.46Å; V366-M370 PolarHBondContact O-N 3.05Å; W367-M370 PolarHBondContact O-N 3.4Å; M370-S374 WeakPolarHBondContact O-CB 3.34Å; M370-S374 PolarHBondContact O-N 3.11Å; M370-S374 PolarHBondContact O-OG 3.12Å; M370-M645 HydrophobicContact CE-CE 3.91Å; M370-M645 HydrophobicContact CE-CG 4.1Å
371	C	93.1	Very high	87.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.1	-48.2	175.1	-67.3	0	0	0	0	111.5	P311 V315 W367 S373 S374 I375	P311-C371 HydrophobicContact CB-CB 3.97Å; V315-C371 HydrophobicContact CG2-CB 3.68Å; W367-C371 VanDerWaalsContact CE2-SG 3.53Å; W367-C371 PolarHBondContact O-N 3.42Å; W367-C371 PolarHBondContact O-SG 3.41Å; C371-S373 VanDerWaalsContact C-N 3.33Å; C371-S373 PolarHBondContact O-N 2.86Å; C371-S374 WeakPolarHBondContact O-CB 3.49Å; C371-S374 PolarHBondContact O-N 3.28Å; C371-S374 VanDerWaalsContact O-N 3.12Å; C371-I375 WeakPolarHBondContact O-CG1 3.28Å; C371-I375 PolarHBondContact O-N 3.05Å
372	S	92.8	Very high	89.1	Confident	7 Å²	7	35.2 Å²	35.2	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-64.7	-37	179.9	-57.4	0	0	0	0	112.2	S343 C368 L369 I375 C376	S343-S372 PolarHBondContact OG-OG 2.86Å; C368-S372 VanDerWaalsContact O-CB 3.27Å; C368-S372 WeakPolarHBondContact O-CB 3.29Å; C368-S372 PolarHBondContact O-N 3.26Å; C368-S372 PolarHBondContact O-OG 2.92Å; L369-S372 PolarHBondContact O-N 2.88Å; S372-I375 PolarHBondContact O-N 2.84Å; S372-C376 WeakPolarHBondContact O-CB 3.36Å; S372-C376 PolarHBondContact O-N 3.46Å
373	S	92.2	Very high	90.1	Very high	56 Å²	56	35.6 Å²	35.6	39%	0.392	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-42.8	171.4	-174.4	0	0	0	0	111.7	L369 C371 I375 C376 L377	L369-S373 WeakPolarHBondContact O-CB 3.49Å; L369-S373 PolarHBondContact O-N 2.71Å; C371-S373 VanDerWaalsContact C-N 3.33Å; C371-S373 PolarHBondContact O-N 2.86Å; S373-I375 PolarHBondContact O-N 3.07Å; S373-C376 WeakPolarHBondContact O-CB 3.47Å; S373-C376 PolarHBondContact O-N 3.29Å; S373-L377 WeakPolarHBondContact O-CG 3.48Å; S373-L377 PolarHBondContact O-N 2.69Å
374	S	93.1	Very high	90.7	Very high	16 Å²	16	38.6 Å²	38.6	11%	0.112	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-44.5	176.3	-57.7	0	0	0	0	112	M370 C371 C376 L377 I378	M370-S374 WeakPolarHBondContact O-CB 3.34Å; M370-S374 PolarHBondContact O-N 3.11Å; M370-S374 PolarHBondContact O-OG 3.12Å; C371-S374 WeakPolarHBondContact O-CB 3.49Å; C371-S374 PolarHBondContact O-N 3.28Å; C371-S374 VanDerWaalsContact O-N 3.12Å; S374-C376 VanDerWaalsContact C-N 3.32Å; S374-C376 PolarHBondContact O-N 3.39Å; S374-L377 PolarHBondContact O-N 2.98Å; S374-I378 WeakPolarHBondContact O-CG1 3.37Å; S374-I378 PolarHBondContact O-N 3.17Å
375	I	93.9	Very high	91	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-35	176.3	-63	164.7	0	0	0	110.9	L314 V315 Q336 L339 F340 C371 S372 S373 I378 Y379	L314-I375 HydrophobicContact CB-CD1 3.86Å; V315-I375 HydrophobicContact CB-CG1 4.39Å; V315-I375 HydrophobicContact CG2-CD1 3.91Å; V315-I375 HydrophobicContact CG2-CG1 3.91Å; Q336-I375 PolarHBondContact NE2-O 3.01Å; L339-I375 HydrophobicContact CG-CG2 4.4Å; F340-I375 HydrophobicContact CB-CG2 3.84Å; F340-I375 HydrophobicContact CD2-CG2 4.27Å; C371-I375 WeakPolarHBondContact O-CG1 3.28Å; C371-I375 PolarHBondContact O-N 3.05Å; S372-I375 PolarHBondContact O-N 2.84Å; S373-I375 PolarHBondContact O-N 3.07Å; I375-I378 PolarHBondContact O-N 2.87Å; I375-Y379 WeakPolarHBondContact O-CB 3.46Å; I375-Y379 PolarHBondContact O-N 2.78Å
376	C	93.8	Very high	91	Very high	37 Å²	37	39.3 Å²	39.3	25%	0.25	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-44.3	172.6	-168.4	0	0	0	0	112.3	F340 S372 S373 S374 I378 Y379 L380	F340-C376 HydrophobicContact CD2-CB 4.09Å; F340-C376 HydrophobicContact CE2-CB 3.57Å; F340-C376 HydrophobicContact CZ-CB 4.04Å; S372-C376 WeakPolarHBondContact O-CB 3.36Å; S372-C376 PolarHBondContact O-N 3.46Å; S373-C376 WeakPolarHBondContact O-CB 3.47Å; S373-C376 PolarHBondContact O-N 3.29Å; S374-C376 VanDerWaalsContact C-N 3.32Å; S374-C376 PolarHBondContact O-N 3.39Å; C376-I378 PolarHBondContact O-N 3.1Å; C376-Y379 WeakPolarHBondContact O-CB 3.45Å; C376-Y379 PolarHBondContact O-N 3.25Å; C376-L380 WeakPolarHBondContact O-CG 3.46Å; C376-L380 PolarHBondContact O-N 2.76Å
377	L	93	Very high	91.1	Very high	97 Å²	97	42.8 Å²	42.8	51%	0.508	22%	0.216	S	C	.	.	H	α-helix	trans	-62.8	-42	176	-71.6	172.1	0	0	0	111.8	S373 S374 Y379 L380 F381	S373-L377 WeakPolarHBondContact O-CG 3.48Å; S373-L377 PolarHBondContact O-N 2.69Å; S374-L377 PolarHBondContact O-N 2.98Å; L377-Y379 VanDerWaalsContact C-N 3.34Å; L377-L380 PolarHBondContact O-N 2.87Å; L377-F381 WeakPolarHBondContact O-CB 3.48Å; L377-F381 PolarHBondContact O-N 2.84Å
378	I	92.4	Very high	90.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-39.6	174.2	-62.6	165	0	0	0	110.6	S318 I319 L322 S374 I375 C376 F381 V382 I638	S318-I378 WeakPolarHBondContact OG-CD1 3.01Å; S318-I378 WeakPolarHBondContact OG-CG2 3.48Å; I319-I378 HydrophobicContact CG1-CD1 3.85Å; L322-I378 HydrophobicContact CB-CG2 4.12Å; L322-I378 HydrophobicContact CD1-CG2 4.31Å; L322-I378 HydrophobicContact CD2-CG1 4.37Å; L322-I378 HydrophobicContact CD2-CG2 4.2Å; L322-I378 HydrophobicContact CG-CG2 4.44Å; S374-I378 WeakPolarHBondContact O-CG1 3.37Å; S374-I378 PolarHBondContact O-N 3.17Å; I375-I378 PolarHBondContact O-N 2.87Å; C376-I378 PolarHBondContact O-N 3.1Å; I378-F381 PolarHBondContact O-N 2.87Å; I378-V382 HydrophobicContact CG2-CG2 4.47Å; I378-V382 VanDerWaalsContact O-CG2 3.32Å; I378-V382 WeakPolarHBondContact O-CG2 3.13Å; I378-V382 PolarHBondContact O-N 3.49Å; I378-I638 HydrophobicContact CD1-CG2 4.33Å; I378-I638 HydrophobicContact CG1-CG2 3.68Å
379	Y	93	Very high	90.6	Very high	31 Å²	31	49.4 Å²	49.4	12%	0.122	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-47.1	174.6	179.5	-127.1	0	0	0	112.8	Q336 L337 I375 C376 L377 F381 V382 L383	Q336-Y379 HydrophobicContact CB-CD2 4.19Å; Q336-Y379 HydrophobicContact CG-CD2 3.86Å; Q336-Y379 HydrophobicContact CG-CG 4.28Å; L337-Y379 HydrophobicContact CB-CD2 4.38Å; L337-Y379 HydrophobicContact CB-CE2 3.7Å; L337-Y379 HydrophobicContact CD1-CE1 4.06Å; L337-Y379 HydrophobicContact CD1-CE2 4.45Å; I375-Y379 WeakPolarHBondContact O-CB 3.46Å; I375-Y379 PolarHBondContact O-N 2.78Å; C376-Y379 WeakPolarHBondContact O-CB 3.45Å; C376-Y379 PolarHBondContact O-N 3.25Å; L377-Y379 VanDerWaalsContact C-N 3.34Å; Y379-F381 VanDerWaalsContact C-N 3.34Å; Y379-F381 PolarHBondContact O-N 2.9Å; Y379-V382 PolarHBondContact O-N 2.76Å; Y379-L383 HydrophobicContact CD1-CD1 4.13Å; Y379-L383 HydrophobicContact CD2-CD1 4.42Å; Y379-L383 HydrophobicContact CD2-CG 4.15Å; Y379-L383 HydrophobicContact CE1-CD1 3.62Å; Y379-L383 HydrophobicContact CE1-CG 4.35Å; Y379-L383 HydrophobicContact CE2-CD1 3.93Å; Y379-L383 HydrophobicContact CE2-CD2 3.95Å; Y379-L383 HydrophobicContact CE2-CG 3.75Å; Y379-L383 WeakPolarHBondContact O-CB 3.49Å; Y379-L383 WeakPolarHBondContact O-CG 3.3Å; Y379-L383 PolarHBondContact O-N 3.23Å
380	L	92.1	Very high	90.3	Very high	84 Å²	84	46.9 Å²	46.9	44%	0.44	24%	0.235	S	C	.	.	H	α-helix	trans	-62.4	-40.5	176.1	-69.3	172.4	0	0	0	111.5	C376 L377 L383 I384	C376-L380 WeakPolarHBondContact O-CG 3.46Å; C376-L380 PolarHBondContact O-N 2.76Å; L377-L380 PolarHBondContact O-N 2.87Å; L380-L383 PolarHBondContact O-N 3.32Å; L380-I384 WeakPolarHBondContact O-CB 3.17Å; L380-I384 WeakPolarHBondContact O-CD1 3.29Å; L380-I384 WeakPolarHBondContact O-CG1 3.26Å; L380-I384 PolarHBondContact O-N 3.21Å
381	F	91.6	Very high	90	Very high	15 Å²	15	52.1 Å²	52.1	7%	0.066	25%	0.251	C	S	.	.	H	α-helix	trans	-59.4	-48.3	172.9	178.3	-83	0	0	0	111.7	L322 L377 I378 Y379 L383 I384 H385 L631 L634 K635 I638	L322-F381 HydrophobicContact CD1-CD1 3.5Å; L322-F381 VanDerWaalsContact CD1-CD1 3.5Å; L322-F381 HydrophobicContact CD1-CE1 3.58Å; L377-F381 WeakPolarHBondContact O-CB 3.48Å; L377-F381 PolarHBondContact O-N 2.84Å; I378-F381 PolarHBondContact O-N 2.87Å; Y379-F381 VanDerWaalsContact C-N 3.34Å; Y379-F381 PolarHBondContact O-N 2.9Å; F381-L383 PolarHBondContact O-N 3.03Å; F381-I384 PolarHBondContact O-N 3.08Å; F381-H385 WeakPolarHBondContact O-CB 3.5Å; F381-H385 PolarHBondContact O-N 2.88Å; F381-L631 HydrophobicContact CE1-CD1 4.35Å; F381-L631 HydrophobicContact CE2-CD1 3.76Å; F381-L631 HydrophobicContact CZ-CD1 3.42Å; F381-L631 VanDerWaalsContact CZ-CD1 3.42Å; F381-L631 HydrophobicContact CZ-CG 3.94Å; F381-L634 HydrophobicContact CD2-CD2 3.79Å; F381-L634 HydrophobicContact CD2-CG 3.86Å; F381-L634 HydrophobicContact CE2-CB 3.98Å; F381-L634 HydrophobicContact CE2-CD2 3.76Å; F381-L634 HydrophobicContact CE2-CG 3.71Å; F381-K635 HydrophobicContact CE1-CD 4.49Å; F381-K635 HydrophobicContact CE1-CG 3.79Å; F381-K635 HydrophobicContact CE2-CG 4.37Å; F381-K635 HydrophobicContact CZ-CD 4.5Å; F381-K635 HydrophobicContact CZ-CG 3.51Å; F381-I638 HydrophobicContact CB-CD1 4.11Å; F381-I638 HydrophobicContact CD2-CD1 3.85Å; F381-I638 HydrophobicContact CG-CD1 4.11Å
382	V	90.1	Very high	89.5	Confident	6 Å²	6	55.9 Å²	55.9	4%	0.036	27%	0.268	C	S	.	.	H	α-helix	trans	-62.5	-41.3	178.1	169.1	0	0	0	0	111.3	L322 L332 I378 Y379 H385 H386	L322-V382 HydrophobicContact CD1-CG2 4.28Å; L332-V382 HydrophobicContact CD2-CG1 4.28Å; L332-V382 HydrophobicContact CD2-CG2 4.38Å; L332-V382 HydrophobicContact CG-CG1 4.02Å; L332-V382 HydrophobicContact CG-CG2 4.46Å; I378-V382 HydrophobicContact CG2-CG2 4.47Å; I378-V382 VanDerWaalsContact O-CG2 3.32Å; I378-V382 WeakPolarHBondContact O-CG2 3.13Å; I378-V382 PolarHBondContact O-N 3.49Å; Y379-V382 PolarHBondContact O-N 2.76Å; V382-H385 PolarHBondContact O-N 2.91Å; V382-H386 WeakPolarHBondContact O-CB 3.43Å; V382-H386 PolarHBondContact O-N 3.43Å
383	L	90.8	Very high	88.9	Confident	38 Å²	38	59.1 Å²	59.1	20%	0.199	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-41.4	174.6	-75.8	-178.9	0	0	0	113	Y379 L380 F381 H386 R387	Y379-L383 HydrophobicContact CD1-CD1 4.13Å; Y379-L383 HydrophobicContact CD2-CD1 4.42Å; Y379-L383 HydrophobicContact CD2-CG 4.15Å; Y379-L383 HydrophobicContact CE1-CD1 3.62Å; Y379-L383 HydrophobicContact CE1-CG 4.35Å; Y379-L383 HydrophobicContact CE2-CD1 3.93Å; Y379-L383 HydrophobicContact CE2-CD2 3.95Å; Y379-L383 HydrophobicContact CE2-CG 3.75Å; Y379-L383 WeakPolarHBondContact O-CB 3.49Å; Y379-L383 WeakPolarHBondContact O-CG 3.3Å; Y379-L383 PolarHBondContact O-N 3.23Å; L380-L383 PolarHBondContact O-N 3.32Å; F381-L383 PolarHBondContact O-N 3.03Å; L383-H386 PolarHBondContact O-N 2.9Å; L383-R387 WeakPolarHBondContact O-CB 3.28Å; L383-R387 WeakPolarHBondContact O-CG 3.35Å; L383-R387 PolarHBondContact O-N 3.36Å
384	I	89.1	Confident	88.5	Confident	116 Å²	116	62 Å²	62	60%	0.595	29%	0.292	S	S	*	.	H	α-helix	trans	-64.9	-44.7	176.4	-71.5	164.2	0	0	0	109.6	L380 F381 R387 F388	L380-I384 WeakPolarHBondContact O-CB 3.17Å; L380-I384 WeakPolarHBondContact O-CD1 3.29Å; L380-I384 WeakPolarHBondContact O-CG1 3.26Å; L380-I384 PolarHBondContact O-N 3.21Å; F381-I384 PolarHBondContact O-N 3.08Å; I384-R387 PolarHBondContact O-N 2.92Å; I384-F388 VanDerWaalsContact O-CB 3.31Å; I384-F388 WeakPolarHBondContact O-CB 3.4Å; I384-F388 PolarHBondContact O-N 2.86Å
385	H	87	Confident	87.8	Confident	47 Å²	47	69.4 Å²	69.4	22%	0.218	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-48.4	175.2	-175.9	-112	0	0	0	111.7	F381 V382 R387 F388 V389	F381-H385 WeakPolarHBondContact O-CB 3.5Å; F381-H385 PolarHBondContact O-N 2.88Å; V382-H385 PolarHBondContact O-N 2.91Å; H385-R387 PolarHBondContact O-N 2.82Å; H385-F388 PolarHBondContact O-N 2.86Å; H385-F388 VanDerWaalsContact O-N 3.17Å; H385-V389 WeakPolarHBondContact O-CG2 3.35Å; H385-V389 PolarHBondContact O-N 2.81Å
386	H	86.7	Confident	87	Confident	36 Å²	36	75 Å²	75	17%	0.167	34%	0.341	C	S	.	.	H	α-helix	trans	-55.4	-51.6	174.7	-178.6	-85.3	0	0	0	111.4	V382 L383 F388 V389 C390	V382-H386 WeakPolarHBondContact O-CB 3.43Å; V382-H386 PolarHBondContact O-N 3.43Å; L383-H386 PolarHBondContact O-N 2.9Å; H386-F388 VanDerWaalsContact C-N 3.3Å; H386-F388 PolarHBondContact O-N 3.22Å; H386-V389 PolarHBondContact O-N 3.15Å; H386-C390 VanDerWaalsContact CE1-SG 3.51Å; H386-C390 WeakPolarHBondContact O-CB 3.49Å; H386-C390 PolarHBondContact O-N 2.78Å; H386-C390 PolarHBondContact O-SG 2.88Å
387	R	87.2	Confident	86.1	Confident	161 Å²	161	79.7 Å²	79.7	61%	0.608	36%	0.355	S	S	*	.	H	α-helix	trans	-62.2	-34.3	177.4	-75.2	-180	171.3	-166.4	-2	113.1	L383 I384 H385 R391	L383-R387 WeakPolarHBondContact O-CB 3.28Å; L383-R387 WeakPolarHBondContact O-CG 3.35Å; L383-R387 PolarHBondContact O-N 3.36Å; I384-R387 PolarHBondContact O-N 2.92Å; H385-R387 PolarHBondContact O-N 2.82Å; R387-R391 WeakPolarHBondContact O-CB 3.31Å; R387-R391 VanDerWaalsContact O-CG 3.28Å; R387-R391 WeakPolarHBondContact O-CG 3.27Å; R387-R391 PolarHBondContact O-N 2.91Å
388	F	85.8	Confident	85.3	Confident	134 Å²	134	80.4 Å²	80.4	59%	0.588	36%	0.355	S	S	*	.	H	α-helix	trans	-69.6	-46.4	176.1	-169.8	-90.6	0	0	0	111.4	I384 H385 H386 R391 F392	I384-F388 VanDerWaalsContact O-CB 3.31Å; I384-F388 WeakPolarHBondContact O-CB 3.4Å; I384-F388 PolarHBondContact O-N 2.86Å; H385-F388 PolarHBondContact O-N 2.86Å; H385-F388 VanDerWaalsContact O-N 3.17Å; H386-F388 VanDerWaalsContact C-N 3.3Å; H386-F388 PolarHBondContact O-N 3.22Å; F388-R391 PolarHBondContact O-N 2.82Å; F388-F392 VanDerWaalsContact O-CB 3.3Å; F388-F392 WeakPolarHBondContact O-CB 3.49Å; F388-F392 PolarHBondContact O-N 2.82Å
389	V	83.2	Confident	84.5	Confident	13 Å²	13	86.4 Å²	86.4	8%	0.079	38%	0.383	C	S	.	.	H	α-helix	trans	-59.3	-48.4	174.4	171.8	0	0	0	0	110.8	H385 H386 R391 F392 L393	H385-V389 WeakPolarHBondContact O-CG2 3.35Å; H385-V389 PolarHBondContact O-N 2.81Å; H386-V389 PolarHBondContact O-N 3.15Å; V389-R391 PolarHBondContact O-N 2.94Å; V389-F392 PolarHBondContact O-N 2.83Å; V389-L393 HydrophobicContact CG1-CD1 3.82Å; V389-L393 HydrophobicContact CG1-CG 4.28Å; V389-L393 WeakPolarHBondContact O-CB 3.29Å; V389-L393 WeakPolarHBondContact O-CG 3.3Å; V389-L393 PolarHBondContact O-N 2.93Å
390	C	84.3	Confident	83.7	Confident	31 Å²	31	89.9 Å²	89.9	21%	0.209	40%	0.403	C	S	.	.	H	α-helix	trans	-57.6	-47.2	176.3	-66.6	0	0	0	0	112.3	H386 F392 L393 Q394	H386-C390 VanDerWaalsContact CE1-SG 3.51Å; H386-C390 WeakPolarHBondContact O-CB 3.49Å; H386-C390 PolarHBondContact O-N 2.78Å; H386-C390 PolarHBondContact O-SG 2.88Å; C390-F392 VanDerWaalsContact C-N 3.33Å; C390-F392 PolarHBondContact O-N 2.95Å; C390-L393 PolarHBondContact O-N 2.85Å; C390-Q394 VanDerWaalsContact O-CB 3.29Å; C390-Q394 WeakPolarHBondContact O-CB 3.43Å; C390-Q394 PolarHBondContact O-N 3.12Å
391	R	84.7	Confident	82.5	Confident	169 Å²	169	94.8 Å²	94.8	64%	0.638	42%	0.417	S	S	*	.	H	α-helix	trans	-63.7	-36.1	176.6	-76.6	173.6	171	-175.2	-3.1	112.7	R387 F388 V389 R395	R387-R391 WeakPolarHBondContact O-CB 3.31Å; R387-R391 VanDerWaalsContact O-CG 3.28Å; R387-R391 WeakPolarHBondContact O-CG 3.27Å; R387-R391 PolarHBondContact O-N 2.91Å; F388-R391 PolarHBondContact O-N 2.82Å; V389-R391 PolarHBondContact O-N 2.94Å; R391-R395 VanDerWaalsContact O-CG 3.32Å; R391-R395 WeakPolarHBondContact O-CG 3.29Å; R391-R395 PolarHBondContact O-N 2.86Å; R391-R395 VanDerWaalsContact O-N 3.08Å
392	F	82.4	Confident	81	Confident	78 Å²	78	102.5 Å²	102.5	34%	0.342	45%	0.446	S	S	.	.	H	α-helix	trans	-71.9	-43.7	179	-174.2	-105.4	0	0	0	112	F388 V389 C390 R395 K396 Y625	F388-F392 VanDerWaalsContact O-CB 3.3Å; F388-F392 WeakPolarHBondContact O-CB 3.49Å; F388-F392 PolarHBondContact O-N 2.82Å; V389-F392 PolarHBondContact O-N 2.83Å; C390-F392 VanDerWaalsContact C-N 3.33Å; C390-F392 PolarHBondContact O-N 2.95Å; F392-R395 PolarHBondContact O-N 3.25Å; F392-K396 HydrophobicContact CD1-CD 4.44Å; F392-K396 HydrophobicContact CE1-CD 3.93Å; F392-K396 HydrophobicContact CZ-CD 4.36Å; F392-K396 PolarHBondContact O-N 3.32Å; F392-Y625 WeakPolarHBondContact CD1-OH 3.39Å
393	L	81.5	Confident	79.6	Confident	76 Å²	76	108 Å²	108	40%	0.398	48%	0.475	S	S	.	.	H	α-helix	trans	-60.4	-47.8	171.8	-70.4	172.6	0	0	0	110.8	V389 C390 R395 K396 Y397	V389-L393 HydrophobicContact CG1-CD1 3.82Å; V389-L393 HydrophobicContact CG1-CG 4.28Å; V389-L393 WeakPolarHBondContact O-CB 3.29Å; V389-L393 WeakPolarHBondContact O-CG 3.3Å; V389-L393 PolarHBondContact O-N 2.93Å; C390-L393 PolarHBondContact O-N 2.85Å; L393-R395 VanDerWaalsContact C-N 3.3Å; L393-R395 PolarHBondContact O-N 3.14Å; L393-K396 PolarHBondContact O-N 2.96Å; L393-K396 VanDerWaalsContact O-N 3.08Å; L393-Y397 HydrophobicContact CB-CD2 4.47Å; L393-Y397 HydrophobicContact CB-CE2 4.49Å; L393-Y397 VanDerWaalsContact O-CD2 3.24Å; L393-Y397 WeakPolarHBondContact O-CD2 3.4Å; L393-Y397 PolarHBondContact O-N 3.42Å
394	Q	81.9	Confident	78	Confident	117 Å²	117	110.7 Å²	110.7	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-56.1	-43.1	177.2	-171.4	-179.6	23.4	0	0	112.1	C390 Q398	C390-Q394 VanDerWaalsContact O-CB 3.29Å; C390-Q394 WeakPolarHBondContact O-CB 3.43Å; C390-Q394 PolarHBondContact O-N 3.12Å; Q394-Q398 WeakPolarHBondContact O-CB 3.44Å; Q394-Q398 VanDerWaalsContact O-CG 3.29Å; Q394-Q398 WeakPolarHBondContact O-CG 3.01Å; Q394-Q398 PolarHBondContact O-N 3.09Å
395	R	80	Confident	76.5	Confident	170 Å²	170	108.4 Å²	108.4	64%	0.642	49%	0.491	S	S	*	.	H	α-helix	trans	-63.3	-45.8	173.4	-74.5	172.6	177.5	-172.2	-2.1	112.1	R391 F392 L393 Q398 H399	R391-R395 VanDerWaalsContact O-CG 3.32Å; R391-R395 WeakPolarHBondContact O-CG 3.29Å; R391-R395 PolarHBondContact O-N 2.86Å; R391-R395 VanDerWaalsContact O-N 3.08Å; F392-R395 PolarHBondContact O-N 3.25Å; L393-R395 VanDerWaalsContact C-N 3.3Å; L393-R395 PolarHBondContact O-N 3.14Å; R395-Q398 PolarHBondContact O-N 2.93Å; R395-H399 PolarHBondContact O-CD2 3.24Å; R395-H399 PolarHBondContact O-N 2.99Å
396	K	75.8	Confident	74.9	Confident	117 Å²	117	114 Å²	114	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-61.1	-45	177.3	-82.8	-168.9	168.7	-172.9	0	112.3	F392 L393 Q398 H399 L400	F392-K396 HydrophobicContact CD1-CD 4.44Å; F392-K396 HydrophobicContact CE1-CD 3.93Å; F392-K396 HydrophobicContact CZ-CD 4.36Å; F392-K396 PolarHBondContact O-N 3.32Å; L393-K396 PolarHBondContact O-N 2.96Å; L393-K396 VanDerWaalsContact O-N 3.08Å; K396-Q398 VanDerWaalsContact C-N 3.35Å; K396-Q398 PolarHBondContact O-N 2.92Å; K396-H399 PolarHBondContact O-N 3.02Å; K396-L400 WeakPolarHBondContact O-CG 3.28Å; K396-L400 PolarHBondContact O-N 3.07Å
397	Y	74.8	Confident	73.2	Confident	136 Å²	136	115.2 Å²	115.2	53%	0.533	54%	0.537	S	S	.	.	H	α-helix	trans	-61	-40.9	175.1	-80.1	-67.6	0	0	0	112.3	L393 H399 L400 Y401	L393-Y397 HydrophobicContact CB-CD2 4.47Å; L393-Y397 HydrophobicContact CB-CE2 4.49Å; L393-Y397 VanDerWaalsContact O-CD2 3.24Å; L393-Y397 WeakPolarHBondContact O-CD2 3.4Å; L393-Y397 PolarHBondContact O-N 3.42Å; Y397-H399 PolarHBondContact O-N 2.99Å; Y397-L400 PolarHBondContact O-N 2.84Å; Y397-Y401 WeakPolarHBondContact O-CB 3.25Å; Y397-Y401 PolarHBondContact O-N 3.39Å
398	Q	76.6	Confident	71.4	Confident	112 Å²	112	112.1 Å²	112.1	52%	0.523	54%	0.54	S	S	.	.	H	α-helix	trans	-63.1	-37	174.7	-75.3	173.5	-11.6	0	0	113.2	Q394 R395 K396 R402	Q394-Q398 WeakPolarHBondContact O-CB 3.44Å; Q394-Q398 VanDerWaalsContact O-CG 3.29Å; Q394-Q398 WeakPolarHBondContact O-CG 3.01Å; Q394-Q398 PolarHBondContact O-N 3.09Å; R395-Q398 PolarHBondContact O-N 2.93Å; K396-Q398 VanDerWaalsContact C-N 3.35Å; K396-Q398 PolarHBondContact O-N 2.92Å; Q398-R402 WeakPolarHBondContact O-CG 3.49Å; Q398-R402 PolarHBondContact O-N 3.03Å
399	H	75.4	Confident	69.5	Low	127 Å²	127	112.5 Å²	112.5	59%	0.588	55%	0.548	S	S	*	.	H	α-helix	trans	-69.1	-44.3	174.2	-87.5	-87.4	0	0	0	112.6	R395 K396 Y397 Y401 R402 L403	R395-H399 PolarHBondContact O-CD2 3.24Å; R395-H399 PolarHBondContact O-N 2.99Å; K396-H399 PolarHBondContact O-N 3.02Å; Y397-H399 PolarHBondContact O-N 2.99Å; H399-Y401 PolarHBondContact O-N 3.29Å; H399-R402 PolarHBondContact O-N 3.43Å; H399-L403 PolarHBondContact O-N 3.38Å
400	L	75.8	Confident	67.6	Low	104 Å²	104	120.4 Å²	120.4	55%	0.545	58%	0.584	S	S	.	*	H	α-helix	trans	-62.8	-41.7	178.3	-70.9	170.8	0	0	0	112	K396 Y397 R402 L403 S404	K396-L400 WeakPolarHBondContact O-CG 3.28Å; K396-L400 PolarHBondContact O-N 3.07Å; Y397-L400 PolarHBondContact O-N 2.84Å; L400-R402 VanDerWaalsContact C-N 3.35Å; L400-R402 PolarHBondContact O-N 2.92Å; L400-L403 PolarHBondContact O-N 2.92Å; L400-S404 PolarHBondContact O-N 3.11Å
401	Y	67.9	Low	65.7	Low	188 Å²	188	126.6 Å²	126.6	74%	0.737	62%	0.615	S	S	*	*	H	α-helix	trans	-62.9	-39.2	176.6	-165.3	-91.8	0	0	0	112.4	Y397 H399 S404 S405	Y397-Y401 WeakPolarHBondContact O-CB 3.25Å; Y397-Y401 PolarHBondContact O-N 3.39Å; H399-Y401 PolarHBondContact O-N 3.29Å; Y401-S404 PolarHBondContact O-N 3.29Å; Y401-S405 PolarHBondContact O-N 3.47Å
402	R	59.4	Low	63.4	Low	177 Å²	177	127.5 Å²	127.5	67%	0.668	62%	0.624	S	S	*	*	H	α-helix	trans	-64.7	-44.5	173.8	-74.3	-175.9	-176.1	-168.6	2.9	112.3	Q398 H399 L400 S404 S405 F406	Q398-R402 WeakPolarHBondContact O-CG 3.49Å; Q398-R402 PolarHBondContact O-N 3.03Å; H399-R402 PolarHBondContact O-N 3.43Å; L400-R402 VanDerWaalsContact C-N 3.35Å; L400-R402 PolarHBondContact O-N 2.92Å; R402-S404 VanDerWaalsContact C-N 3.32Å; R402-S404 PolarHBondContact O-N 3.39Å; R402-S405 PolarHBondContact O-N 3.43Å; R402-S405 VanDerWaalsContact O-N 3.11Å; R402-S405 PolarHBondContact O-OG 3.48Å; R402-F406 PolarHBondContact O-N 3.45Å
403	L	60.8	Low	61.4	Low	122 Å²	122	129.8 Å²	129.8	64%	0.639	64%	0.644	S	S	*	*	H	α-helix	trans	-61.1	-41.7	176.8	-81.9	157	0	0	0	111.6	H399 L400 S405 F406 G407	H399-L403 PolarHBondContact O-N 3.38Å; L400-L403 PolarHBondContact O-N 2.92Å; L403-S405 VanDerWaalsContact C-N 3.25Å; L403-S405 PolarHBondContact O-N 2.85Å; L403-F406 PolarHBondContact O-N 3.18Å; L403-F406 VanDerWaalsContact O-N 3.13Å; L403-G407 PolarHBondContact O-N 3.46Å
404	S	58.6	Low	59.3	Low	93 Å²	93	133 Å²	133	65%	0.65	67%	0.668	S	S	*	*	H	α-helix	trans	-58.5	-34.8	173.7	-167	0	0	0	0	113	L400 Y401 R402	L400-S404 PolarHBondContact O-N 3.11Å; Y401-S404 PolarHBondContact O-N 3.29Å; R402-S404 VanDerWaalsContact C-N 3.32Å; R402-S404 PolarHBondContact O-N 3.39Å
405	S	56.7	Low	57.4	Low	68 Å²	68	134 Å²	134	48%	0.476	68%	0.682	S	S	.	*	H	α-helix	trans	-74.6	-19.9	177.5	62.8	0	0	0	0	115.1	Y401 R402 L403	Y401-S405 PolarHBondContact O-N 3.47Å; R402-S405 PolarHBondContact O-N 3.43Å; R402-S405 VanDerWaalsContact O-N 3.11Å; R402-S405 PolarHBondContact O-OG 3.48Å; L403-S405 VanDerWaalsContact C-N 3.25Å; L403-S405 PolarHBondContact O-N 2.85Å
406	F	53.2	Low	55.5	Low	165 Å²	165	130.9 Å²	130.9	72%	0.724	69%	0.692	S	S	*	*	H	α-helix	trans	-87.2	-30.3	176.4	-89.6	-83.9	0	0	0	113	R402 L403 S408 N409	R402-F406 PolarHBondContact O-N 3.45Å; L403-F406 PolarHBondContact O-N 3.18Å; L403-F406 VanDerWaalsContact O-N 3.13Å; F406-S408 PolarHBondContact O-N 2.79Å; F406-N409 PolarHBondContact O-N 2.73Å
407	G	51.7	Low	53.6	Low	62 Å²	62	128.8 Å²	128.8	64%	0.639	70%	0.703	S	S	*	*	H	α-helix	trans	-63.5	-21.4	-179.5	0	0	0	0	0	115	L403 N409	L403-G407 PolarHBondContact O-N 3.46Å; G407-N409 PolarHBondContact O-N 2.88Å
408	S	48.5	Very low	51.6	Low	96 Å²	96	131.3 Å²	131.3	67%	0.671	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-6.7	-175.3	-165	0	0	0	0	115.1	F406	F406-S408 PolarHBondContact O-N 2.79Å
409	N	46.2	Very low	49.6	Very low	141 Å²	141	132.1 Å²	132.1	75%	0.754	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	7.4	-167.7	-81	-1.7	0	0	0	115.7	F406 G407	F406-N409 PolarHBondContact O-N 2.73Å; G407-N409 PolarHBondContact O-N 2.88Å
410	Q	44.1	Very low	47.8	Very low	179 Å²	179	131.8 Å²	131.8	84%	0.836	73%	0.733	S	S	*	*			trans	-101.4	-8.3	178	-73.1	-166.7	-24.5	0	0	115.2	K412	Q410-K412 PolarHBondContact O-N 2.97Å
411	N	43.1	Very low	46	Very low	161 Å²	161	135.9 Å²	135.9	86%	0.861	75%	0.749	S	S	*	*			trans	-85.3	70.3	178.9	-77.1	-0.7	0	0	0	112.8
412	K	38.2	Very low	44.4	Very low	189 Å²	189	130.5 Å²	130.5	82%	0.822	75%	0.751	S	S	*	*	S	Bend	trans	-150.3	84.6	158.7	-128.7	174.4	-175.3	-179.6	0	115.1	Q410	Q410-K412 PolarHBondContact O-N 2.97Å
413	T	40.3	Very low	43.4	Very low	125 Å²	125	127.6 Å²	127.6	77%	0.767	76%	0.755	S	S	*	*			trans	50.5	98.8	142.4	55.9	0	0	0	0	119
414	T	36.3	Very low	42.3	Very low	145 Å²	145	128.5 Å²	128.5	89%	0.89	76%	0.759	S	S	*	*			trans	-92.4	110	149.9	46.6	0	0	0	0	110.3
415	T	41.7	Very low	41.4	Very low	138 Å²	138	130.5 Å²	130.5	85%	0.847	76%	0.762	S	S	*	*			trans	-151.6	136.1	164	-45.5	0	0	0	0	108.6
416	A	39.9	Very low	40.5	Very low	104 Å²	104	134.3 Å²	134.3	86%	0.86	77%	0.772	S	S	*	*			trans	-110.5	147.7	179.8	0	0	0	0	0	110.5
417	G	36.3	Very low	39.8	Very low	72 Å²	72	136.4 Å²	136.4	74%	0.742	78%	0.776	S	S	*	*			trans	156.2	109.2	172.6	0	0	0	0	0	114.5
418	F	33.8	Very low	39.2	Very low	190 Å²	190	138.7 Å²	138.7	83%	0.833	78%	0.777	S	S	*	*			trans	32.4	107.9	149	-89.1	-104.2	0	0	0	120.9
419	N	34.8	Very low	38.7	Very low	129 Å²	129	142.1 Å²	142.1	69%	0.69	79%	0.788	S	S	*	*				55	146.4	120.6	-61.7	6.8	0	0	0	123.3
420	T	36.5	Very low	38.1	Very low	120 Å²	120	138.7 Å²	138.7	74%	0.736	79%	0.786	S	S	*	*			trans	68.6	98.1	153.3	39.1	0	0	0	0	120.1
421	E	38	Very low	37.9	Very low	189 Å²	189	137 Å²	137	88%	0.883	79%	0.79	S	S	*	*				69	140.5	129.3	-61	179.5	159.3	0	0	121.6
422	G	34.9	Very low	37.6	Very low	76 Å²	76	132.2 Å²	132.2	78%	0.784	78%	0.78	S	S	*	*			trans	94.5	104.2	162.8	0	0	0	0	0	117.1
423	P	37	Very low	37.6	Very low	115 Å²	115	131 Å²	131	75%	0.747	78%	0.78	S	S	*	*			trans	-99.8	173	173.6	38.1	-33.6	0	0	0	114.1
424	I	39.3	Very low	37.3	Very low	141 Å²	141	132.6 Å²	132.6	72%	0.723	78%	0.781	S	S	*	*			trans	105.6	105.2	159.7	-57	160.3	0	0	0	117.1
425	N	40	Very low	37.3	Very low	135 Å²	135	133.1 Å²	133.1	72%	0.722	77%	0.773	S	S	*	*			trans	62.3	152.6	146	-61.8	16.2	0	0	0	120.1
426	E	37.6	Very low	37	Very low	148 Å²	148	130.5 Å²	130.5	69%	0.692	76%	0.761	S	S	*	*			cis	-163.1	171.8	-11.5	-124.4	-168.9	106.6	0	0	110.9
427	R	37	Very low	36.8	Very low	210 Å²	210	136.7 Å²	136.7	79%	0.792	76%	0.764	S	S	*	*			trans	66.7	155.8	155.2	-79.5	178.6	179.7	-171.3	-4.8	120
428	T	40.4	Very low	36.7	Very low	110 Å²	110	136.4 Å²	136.4	68%	0.675	76%	0.761	S	S	*	*			cis	-169.9	150.3	-35.8	19.7	0	0	0	0	108.3
429	N	37.6	Very low	36.6	Very low	168 Å²	168	133.8 Å²	133.8	90%	0.898	76%	0.764	S	S	*	*			trans	173	153.4	131.6	-85.9	-21.5	0	0	0	112.8
430	G	33.3	Very low	36.6	Very low	69 Å²	69	134.2 Å²	134.2	71%	0.711	78%	0.776	S	S	*	*			trans	-106	-141.6	-174.3	0	0	0	0	0	114.3
431	P	39.1	Very low	36.5	Very low	142 Å²	142	132.3 Å²	132.3	92%	0.922	78%	0.78	S	S	*	*			cis	-102	-154.5	11.2	44.5	-38.3	0	0	0	111.9
432	G	38.7	Very low	36.3	Very low	62 Å²	62	130.9 Å²	130.9	64%	0.639	78%	0.778	S	S	*	*			cis	179.9	-172.8	4.4	0	0	0	0	0	113.9
433	I	36.3	Very low	36.3	Very low	163 Å²	163	133.3 Å²	133.3	84%	0.836	78%	0.782	S	S	*	*			trans	48.9	87	170.6	-47.7	-179.3	0	0	0	115.5
434	M	33.9	Very low	36.3	Very low	159 Å²	159	131.8 Å²	131.8	78%	0.783	79%	0.787	S	S	*	*				72.7	134.9	78.8	-75.6	-175.6	149.7	0	0	116.7
435	Q	37	Very low	36.3	Very low	155 Å²	155	128.8 Å²	128.8	72%	0.724	79%	0.791	S	S	*	*			cis	-167.4	155.2	-26.6	-130.5	174.4	-0.9	0	0	111.4
436	S	35.8	Very low	35.8	Very low	83 Å²	83	128.3 Å²	128.3	58%	0.58	80%	0.797	S	S	*	*			trans	28.9	153.3	142.6	-65.1	0	0	0	0	122.7
437	Y	36.2	Very low	35.9	Very low	235 Å²	235	126.7 Å²	126.7	92%	0.922	80%	0.8	S	S	*	*			cis	-135	156.2	29.9	-53.7	-102.7	0	0	0	112.3
438	G	34.4	Very low	35.8	Very low	66 Å²	66	124.2 Å²	124.2	68%	0.68	80%	0.802	S	S	*	*			cis	140.7	103.8	-5.4	0	0	0	0	0	112.4
439	C	31.8	Very low	35.7	Very low	134 Å²	134	124 Å²	124	91%	0.905	81%	0.805	S	S	*	*			trans	-154.5	93.6	167.6	-146.3	0	0	0	0	109.6
440	C	34	Very low	35.6	Very low	138 Å²	138	121.3 Å²	121.3	93%	0.932	80%	0.798	S	S	*	*			trans	-126.3	137.5	178.2	-67.8	0	0	0	0	109.5
441	G	33.5	Very low	35.7	Very low	80 Å²	80	124.1 Å²	124.1	83%	0.825	80%	0.801	S	S	*	*			trans	-139.4	93.6	177.7	0	0	0	0	0	111.5
442	N	34.4	Very low	35.5	Very low	159 Å²	159	123 Å²	123	85%	0.85	80%	0.797	S	S	*	*				157.5	94.4	120.1	-166.1	35.9	0	0	0	110.7
443	C	34.6	Very low	35.2	Very low	127 Å²	127	125.7 Å²	125.7	86%	0.858	81%	0.805	S	S	*	*			trans	-118.3	143.2	167.7	-65.4	0	0	0	0	108.1
444	G	37.5	Very low	35.2	Very low	83 Å²	83	123.9 Å²	123.9	86%	0.856	80%	0.801	S	S	*	*			trans	-88.6	171.2	-176.9	0	0	0	0	0	114.5
445	G	39.1	Very low	35.4	Very low	79 Å²	79	121 Å²	121	81%	0.814	80%	0.803	S	S	*	*			trans	116.1	107.1	171.7	0	0	0	0	0	113.5
446	C	30.4	Very low	35.3	Very low	125 Å²	125	117.4 Å²	117.4	85%	0.845	81%	0.807	S	S	*	*			trans	-77.8	163.9	165.9	-57.1	0	0	0	0	110.3
447	P	40	Very low	35.2	Very low	114 Å²	114	124.6 Å²	124.6	74%	0.74	82%	0.822	S	S	*	*				-141.7	137.1	99.3	36.6	-23.2	0	0	0	115.8
448	D	33.5	Very low	35.1	Very low	157 Å²	157	119.6 Å²	119.6	84%	0.84	82%	0.816	S	S	*	*			trans	37.5	80.1	135.7	-50.5	-23.4	0	0	0	120.2
449	S	39.6	Very low	35.3	Very low	107 Å²	107	121.2 Å²	121.2	75%	0.748	82%	0.816	S	S	*	*			trans	-164.5	153.3	133	49.3	0	0	0	0	112.5
450	C	34.2	Very low	35.4	Very low	111 Å²	111	121 Å²	121	75%	0.75	81%	0.811	S	S	*	*			trans	47.6	82.4	160.7	-57.6	0	0	0	0	118
451	T	36.1	Very low	35.4	Very low	127 Å²	127	117.4 Å²	117.4	78%	0.779	80%	0.797	S	S	*	*				95.3	117.9	77	50	0	0	0	0	115.6
452	S	35.7	Very low	35.4	Very low	118 Å²	118	124 Å²	124	83%	0.825	80%	0.804	S	S	*	*			trans	65.9	150.8	178.8	78.9	0	0	0	0	116
453	C	31.8	Very low	35.3	Very low	120 Å²	120	124.3 Å²	124.3	81%	0.811	80%	0.804	S	S	*	*			cis	-171.3	153.9	-21.7	-95.9	0	0	0	0	105.9
454	V	36.7	Very low	35.3	Very low	125 Å²	125	123.5 Å²	123.5	76%	0.758	80%	0.799	S	S	*	*			cis	-150.6	115.1	-7.6	129.4	0	0	0	0	105.5
455	A	36.8	Very low	35.1	Very low	99 Å²	99	123.7 Å²	123.7	82%	0.818	79%	0.788	S	S	*	*				60.7	119.7	98.7	0	0	0	0	0	117.3
456	G	35.2	Very low	34.8	Very low	79 Å²	79	128 Å²	128	81%	0.814	79%	0.793	S	S	*	*			trans	176.4	70.5	175.7	0	0	0	0	0	118.9
457	R	34.1	Very low	35.2	Very low	234 Å²	234	125.8 Å²	125.8	88%	0.883	79%	0.791	S	S	*	*			trans	38.7	122.6	152.8	-66	-179.9	172.3	168.2	-2.7	120.3
458	T	34.8	Very low	34.8	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	80%	0.798	S	S	*	*				54.2	137.8	64.3	74.1	0	0	0	0	114.4
459	S	36.7	Very low	34.8	Very low	99 Å²	99	124.4 Å²	124.4	69%	0.692	80%	0.795	S	S	*	*			cis	-162.4	171.2	20.9	54.1	0	0	0	0	113.2
460	T	35.7	Very low	34.5	Very low	129 Å²	129	125.3 Å²	125.3	79%	0.791	80%	0.796	S	S	*	*			trans	28.3	133.5	146.7	56.7	0	0	0	0	120.8
461	G	33.6	Very low	34.2	Very low	63 Å²	63	124.7 Å²	124.7	65%	0.649	79%	0.792	S	S	*	*			cis	103.4	122.4	14.6	0	0	0	0	0	113
462	F	32.1	Very low	34	Very low	218 Å²	218	129 Å²	129	96%	0.956	80%	0.796	S	S	*	*			trans	-166.9	158.5	163.8	-101.1	-64.4	0	0	0	112
463	I	32.7	Very low	33.6	Very low	166 Å²	166	128.6 Å²	128.6	85%	0.851	79%	0.793	S	S	*	*			trans	-140.8	134.1	-175.5	-64.4	169.9	0	0	0	110.6
464	S	34.1	Very low	33.7	Very low	110 Å²	110	130.7 Å²	130.7	77%	0.769	80%	0.796	S	S	*	*			trans	-179.4	161	155.1	-127.4	0	0	0	0	109.5
465	S	34.5	Very low	33.3	Very low	88 Å²	88	129.9 Å²	129.9	62%	0.615	80%	0.796	S	S	*	*			cis	178.3	147.6	-35.3	51.2	0	0	0	0	108.1
466	N	33.3	Very low	33.3	Very low	170 Å²	170	130.1 Å²	130.1	91%	0.909	79%	0.792	S	S	*	*			trans	69.3	137.1	173	-60.2	-17.9	0	0	0	117.8
467	G	37.2	Very low	33.4	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	79%	0.794	S	S	*	*			trans	154.2	70.8	-177.5	0	0	0	0	0	112.2
468	T	32	Very low	33.3	Very low	146 Å²	146	124.9 Å²	124.9	90%	0.896	79%	0.789	S	S	*	*			trans	-85.4	132.2	-169.4	48.7	0	0	0	0	114.5
469	A	34.2	Very low	33.2	Very low	95 Å²	95	127.4 Å²	127.4	79%	0.785	80%	0.796	S	S	*	*			trans	-153.2	100.2	163.5	0	0	0	0	0	114.5
470	V	32.9	Very low	33.1	Very low	127 Å²	127	128.2 Å²	128.2	77%	0.77	80%	0.802	S	S	*	*			trans	44.5	109.3	137.4	-172.8	0	0	0	0	120.8
471	C	27.8	Very low	33.1	Very low	98 Å²	98	125.9 Å²	125.9	66%	0.662	80%	0.804	S	S	*	*				43.7	159.1	126.6	-45.8	0	0	0	0	122.2
472	Y	32	Very low	33.2	Very low	217 Å²	217	126.2 Å²	126.2	85%	0.851	81%	0.807	S	S	*	*			cis	-135.9	155	11.1	-92.4	-80.6	0	0	0	112.3
473	S	28	Very low	33.4	Very low	110 Å²	110	121.7 Å²	121.7	77%	0.769	80%	0.802	S	S	*	*			trans	-101.8	154.8	159.5	-60.8	0	0	0	0	110.2
474	N	32.3	Very low	33.4	Very low	164 Å²	164	117 Å²	117	88%	0.877	80%	0.795	S	S	*	*			trans	-158.8	144.4	145.5	-120.6	-21.5	0	0	0	112.5
475	S	30	Very low	33.5	Very low	107 Å²	107	121.3 Å²	121.3	75%	0.748	80%	0.803	S	S	*	*			trans	-156	113.2	-174.7	56.4	0	0	0	0	112
476	S	35.3	Very low	33.5	Very low	105 Å²	105	121.4 Å²	121.4	73%	0.734	81%	0.808	S	S	*	*			trans	-139.3	131.3	174.4	-45.3	0	0	0	0	107
477	C	37	Very low	33.4	Very low	129 Å²	129	119.7 Å²	119.7	87%	0.872	81%	0.808	S	S	*	*				50.1	104.4	65	-56.8	0	0	0	0	110.5
478	G	32.6	Very low	33.2	Very low	74 Å²	74	124.1 Å²	124.1	76%	0.763	81%	0.808	S	S	*	*			cis	112.3	101.5	7.8	0	0	0	0	0	110.6
479	L	33.5	Very low	33.4	Very low	183 Å²	183	121.9 Å²	121.9	96%	0.958	80%	0.804	S	S	*	*			trans	-151.5	160.8	174.2	-144.4	75.8	0	0	0	110.5
480	S	35	Very low	33.5	Very low	116 Å²	116	123.6 Å²	123.6	81%	0.811	80%	0.799	S	S	*	*			trans	-116.9	147.4	-172.4	56.6	0	0	0	0	113
481	G	35.7	Very low	33.9	Very low	80 Å²	80	122.7 Å²	122.7	83%	0.825	80%	0.795	S	S	*	*			trans	147	157.1	154.3	0	0	0	0	0	115.7
482	G	34.1	Very low	34.5	Very low	69 Å²	69	125 Å²	125	71%	0.711	80%	0.8	S	S	*	*			trans	92.4	98.2	153.8	0	0	0	0	0	117.8
483	S	37.9	Very low	34.7	Very low	124 Å²	124	121.1 Å²	121.1	87%	0.867	79%	0.793	S	S	*	*			trans	9.6	121.5	134.8	53.4	0	0	0	0	118.5
484	G	31.9	Very low	35.1	Very low	68 Å²	68	123.9 Å²	123.9	70%	0.701	79%	0.794	S	S	*	*			trans	-77.8	-170.1	-178.6	0	0	0	0	0	117.5
485	H	37	Very low	35.4	Very low	200 Å²	200	122.4 Å²	122.4	93%	0.926	79%	0.791	S	S	*	*			trans	-152.8	159.6	148.6	-108.7	-83.4	0	0	0	108.4
486	A	33.2	Very low	35.6	Very low	89 Å²	89	124.5 Å²	124.5	74%	0.736	79%	0.794	S	S	*	*			trans	-104.1	155.1	-179.3	0	0	0	0	0	112.1
487	C	32	Very low	36.1	Very low	135 Å²	135	124.1 Å²	124.1	91%	0.912	79%	0.789	S	S	*	*			trans	-161.2	163.5	151.5	-114.1	0	0	0	0	110.7
488	Q	32.8	Very low	36	Very low	171 Å²	171	124.9 Å²	124.9	80%	0.799	79%	0.79	S	S	*	*			trans	-127.3	146.7	-160	-59.5	160.6	-85.6	0	0	114.9	I490	Q488-I490 HydrophobicContact CB-CD1 4.03Å
489	A	35.4	Very low	36.1	Very low	98 Å²	98	124.9 Å²	124.9	81%	0.81	78%	0.782	S	S	*	*			trans	-165.9	131.2	156.3	0	0	0	0	0	109.2
490	I	38.3	Very low	36.2	Very low	132 Å²	132	123 Å²	123	68%	0.677	77%	0.773	S	S	*	*			cis	82.9	123	-1.9	-50.1	175.4	0	0	0	115.3	Q488	Q488-I490 HydrophobicContact CB-CD1 4.03Å
491	P	40.8	Very low	36.3	Very low	107 Å²	107	125 Å²	125	70%	0.695	78%	0.775	S	S	*	*			cis	-143.2	-129.7	-24	39.9	-16.5	0	0	0	113.3
492	I	39.1	Very low	36.6	Very low	147 Å²	147	126.6 Å²	126.6	75%	0.754	77%	0.773	S	S	*	*			trans	80.4	131	169	-63.4	167.1	0	0	0	115.1
493	L	37.2	Very low	37	Very low	135 Å²	135	129 Å²	129	71%	0.707	78%	0.777	S	S	*	*			cis	-145.5	142.5	-4.6	-146.1	44.6	0	0	0	107.6
494	Q	36.3	Very low	37.2	Very low	168 Å²	168	126.7 Å²	126.7	79%	0.785	77%	0.772	S	S	*	*				40	136.6	99.2	-112.7	176	-8.7	0	0	115.2
495	T	38.1	Very low	37.6	Very low	133 Å²	133	128.8 Å²	128.8	82%	0.816	77%	0.773	S	S	*	*			cis	-136.5	-175.4	34.3	51.4	0	0	0	0	114.9
496	N	35.2	Very low	37.7	Very low	151 Å²	151	127.4 Å²	127.4	81%	0.807	77%	0.771	S	S	*	*			trans	-131.8	-154.5	-169.5	-156.7	12.3	0	0	0	111
497	P	44.4	Very low	37.8	Very low	97 Å²	97	126.7 Å²	126.7	63%	0.63	77%	0.772	S	S	*	*				-121.3	177.8	-122.8	41.2	-23.6	0	0	0	115.6
498	T	35.8	Very low	37.8	Very low	146 Å²	146	129.7 Å²	129.7	90%	0.896	77%	0.77	S	S	*	*			trans	-173.5	168.5	154.2	21.3	0	0	0	0	109
499	A	35.6	Very low	37.9	Very low	73 Å²	73	128.2 Å²	128.2	60%	0.603	77%	0.773	S	S	*	*				-170	145.1	-50.1	0	0	0	0	0	108.2
500	N	34	Very low	37.7	Very low	144 Å²	144	132.4 Å²	132.4	77%	0.77	78%	0.776	S	S	*	*			trans	47.1	129.9	157.8	-53.6	-13	0	0	0	120.5
501	N	38.1	Very low	37.4	Very low	157 Å²	157	130.2 Å²	130.2	84%	0.84	78%	0.777	S	S	*	*				174.8	135.8	108.2	-84.3	-31.5	0	0	0	113
502	S	40.9	Very low	36.8	Very low	114 Å²	114	134 Å²	134	80%	0.797	79%	0.788	S	S	*	*			trans	-93.1	-170.4	162	-39	0	0	0	0	108.4
503	P	43.3	Very low	36.5	Very low	121 Å²	121	130.3 Å²	130.3	79%	0.786	79%	0.786	S	S	*	*			cis	-151	162	25.1	42.5	-20.7	0	0	0	120.7
504	G	41.3	Very low	36.1	Very low	74 Å²	74	132.9 Å²	132.9	76%	0.763	80%	0.8	S	S	*	*			trans	60.9	-165.6	145.7	0	0	0	0	0	120.1
505	P	41.9	Very low	35.9	Very low	113 Å²	113	130.8 Å²	130.8	73%	0.734	80%	0.803	S	S	*	*			cis	-140.8	173.9	-15.2	42.9	-26.6	0	0	0	116.6
506	I	38.5	Very low	35.6	Very low	171 Å²	171	128.1 Å²	128.1	88%	0.877	80%	0.795	S	S	*	*			trans	70.1	136.1	153.3	-68.7	155.7	0	0	0	120.8
507	G	35.5	Very low	35.5	Very low	73 Å²	73	128.6 Å²	128.6	75%	0.753	80%	0.797	S	S	*	*			trans	164.6	105.3	161.8	0	0	0	0	0	114.6
508	F	31.1	Very low	34.9	Very low	199 Å²	199	133 Å²	133	87%	0.873	81%	0.806	S	S	*	*			trans	-99.7	149.1	175.9	-91.3	-105.6	0	0	0	111.8
509	T	35.6	Very low	34.6	Very low	140 Å²	140	137 Å²	137	86%	0.859	81%	0.805	S	S	*	*				174.4	172.5	112.2	32.2	0	0	0	0	113.3
510	Q	31.3	Very low	34.5	Very low	186 Å²	186	141.2 Å²	141.2	87%	0.869	82%	0.818	S	S	*	*			trans	-84.5	163.5	-173.4	-54.6	148.9	-27.8	0	0	112.4
511	A	31.2	Very low	34.5	Very low	86 Å²	86	140.8 Å²	140.8	71%	0.711	82%	0.815	S	S	*	*				173.1	164.9	113.1	0	0	0	0	0	114.7
512	M	29.5	Very low	34.2	Very low	187 Å²	187	143.7 Å²	143.7	92%	0.921	82%	0.816	S	S	*	*			trans	-25.9	160.1	157.8	-59.4	164.7	-72.1	0	0	116.3
513	G	32	Very low	33.9	Very low	69 Å²	69	141.9 Å²	141.9	71%	0.711	82%	0.815	S	S	*	*			cis	161.7	177.7	9.1	0	0	0	0	0	109.4
514	L	29.4	Very low	33.2	Very low	189 Å²	189	143.4 Å²	143.4	99%	0.99	82%	0.817	S	S	*	*			trans	-71.5	135.6	-177.7	-71.4	86.1	0	0	0	112.1
515	S	32	Very low	32.8	Very low	124 Å²	124	147.9 Å²	147.9	87%	0.867	82%	0.823	S	S	*	*			trans	-135.4	138.9	157.5	-176.3	0	0	0	0	108.3
516	A	31.9	Very low	32.2	Very low	77 Å²	77	152.8 Å²	152.8	64%	0.636	83%	0.829	S	S	*	*			trans	-130.8	153.2	-172.9	0	0	0	0	0	111.3
517	N	31.4	Very low	31.8	Very low	160 Å²	160	153.1 Å²	153.1	86%	0.856	83%	0.831	S	S	*	*			trans	64	115.1	165.1	-55.6	-32.6	0	0	0	117.6
518	K	32	Very low	31.5	Very low	189 Å²	189	155.5 Å²	155.5	82%	0.822	84%	0.835	S	S	*	*				157.4	95.4	120.6	-170	172.3	-177.5	-173.1	0	107.3
519	R	30	Very low	31.6	Very low	230 Å²	230	152.1 Å²	152.1	87%	0.868	84%	0.836	S	S	*	*				60.7	94.6	77.5	-173.7	-167.6	-175.7	170.1	3.8	111.6
520	D	33.1	Very low	31.5	Very low	163 Å²	163	148.9 Å²	148.9	87%	0.872	83%	0.83	S	S	*	*			trans	-146.8	172.5	144.9	-89.5	-44.9	0	0	0	109
521	N	34	Very low	31.7	Very low	135 Å²	135	146 Å²	146	72%	0.722	83%	0.831	S	S	*	*			trans	-145.5	156.2	-149.6	-161.6	25.2	0	0	0	113.2
522	Y	32.5	Very low	31.8	Very low	218 Å²	218	147.2 Å²	147.2	86%	0.855	83%	0.834	S	S	*	*			trans	65.7	149.4	176.3	-80.1	-85.5	0	0	0	119.1
523	G	34.9	Very low	32.1	Very low	75 Å²	75	148 Å²	148	77%	0.773	84%	0.835	S	S	*	*			trans	128.8	87.6	155.2	0	0	0	0	0	116.1
524	D	28.1	Very low	32.2	Very low	154 Å²	154	150.5 Å²	150.5	82%	0.824	84%	0.842	S	S	*	*			trans	-68.5	145.7	163.8	-68	-73.3	0	0	0	111.6
525	N	32.3	Very low	32.5	Very low	168 Å²	168	145.2 Å²	145.2	90%	0.898	83%	0.833	S	S	*	*			trans	-166.5	138.1	148.2	-101.4	-47.7	0	0	0	111.6
526	Y	29.4	Very low	32.5	Very low	216 Å²	216	147.9 Å²	147.9	85%	0.847	84%	0.838	S	S	*	*			trans	-92.8	155.6	171	-83	-95.8	0	0	0	111
527	L	31	Very low	32.6	Very low	178 Å²	178	148.1 Å²	148.1	93%	0.932	85%	0.848	S	S	*	*			trans	-126.9	135.9	164.1	-88.9	168	0	0	0	110.2
528	C	28.7	Very low	32.8	Very low	122 Å²	122	144.7 Å²	144.7	82%	0.824	84%	0.841	S	S	*	*			trans	-125.3	140	-178.5	-67	0	0	0	0	110.8
529	S	33.1	Very low	33.1	Very low	128 Å²	128	142.3 Å²	142.3	90%	0.895	84%	0.838	S	S	*	*			trans	-161.8	142.1	157	-169.5	0	0	0	0	109.4
530	G	33	Very low	33.4	Very low	72 Å²	72	138.8 Å²	138.8	74%	0.742	84%	0.836	S	S	*	*			cis	151.7	53.5	-3.5	0	0	0	0	0	114.6
531	S	35.7	Very low	33.5	Very low	126 Å²	126	134.8 Å²	134.8	88%	0.881	83%	0.834	S	S	*	*			trans	-154.3	150.1	170.2	50.7	0	0	0	0	111.8
532	S	34	Very low	33.6	Very low	111 Å²	111	135 Å²	135	78%	0.776	84%	0.84	S	S	*	*			trans	-139.1	144	-168.4	56	0	0	0	0	111
533	E	35.6	Very low	33.5	Very low	203 Å²	203	134.7 Å²	134.7	95%	0.949	84%	0.843	S	S	*	*			trans	-164.6	163.1	140.6	-116.3	170.1	178.6	0	0	111.6
534	S	34.1	Very low	33.2	Very low	122 Å²	122	143 Å²	143	85%	0.853	85%	0.851	S	S	*	*			trans	-132.2	128.7	-172.1	59.1	0	0	0	0	111.7
535	G	35.3	Very low	33.4	Very low	78 Å²	78	138.9 Å²	138.9	80%	0.804	85%	0.846	S	S	*	*			trans	-152	132.7	176.3	0	0	0	0	0	112.5
536	N	32.8	Very low	33.2	Very low	181 Å²	181	139.8 Å²	139.8	97%	0.968	85%	0.85	S	S	*	*			trans	-81.5	143.7	174.1	-73.5	-45.8	0	0	0	110.9
537	G	33.8	Very low	33.1	Very low	82 Å²	82	138.8 Å²	138.8	85%	0.845	84%	0.844	S	S	*	*			trans	-178.8	123.1	170	0	0	0	0	0	111.8
538	A	35.1	Very low	32.9	Very low	87 Å²	87	142.2 Å²	142.2	72%	0.719	85%	0.845	S	S	*	*			trans	-110.2	137	178.1	0	0	0	0	0	110.7
539	N	39.6	Very low	32.9	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	84%	0.841	S	S	*	*				174.2	145	121.9	-89.3	-33.8	0	0	0	113.6
540	N	35.3	Very low	32.8	Very low	155 Å²	155	147.6 Å²	147.6	83%	0.829	84%	0.841	S	S	*	*			trans	38.3	99.1	141.5	-52.9	-21.3	0	0	0	119.3
541	G	36.1	Very low	32.7	Very low	80 Å²	80	149.5 Å²	149.5	83%	0.825	84%	0.843	S	S	*	*			trans	-163.9	100.9	166.1	0	0	0	0	0	112.1
542	T	34.6	Very low	32.5	Very low	139 Å²	139	155 Å²	155	85%	0.853	84%	0.844	S	S	*	*			trans	-74.6	124.9	-173.9	49.6	0	0	0	0	113.3
543	F	30.5	Very low	32.3	Very low	211 Å²	211	159.9 Å²	159.9	93%	0.925	85%	0.845	S	S	*	*			trans	-148	151.6	144.8	-128	-87.7	0	0	0	112.2
544	R	29.9	Very low	32.4	Very low	249 Å²	249	157 Å²	157	94%	0.94	84%	0.842	S	S	*	*			trans	-92.3	127.7	-169.2	-67	-178.2	176.1	-169	-0.4	112.6
545	G	31.1	Very low	32.5	Very low	68 Å²	68	156.7 Å²	156.7	70%	0.701	83%	0.83	S	S	*	*			trans	-143	108.2	166.4	0	0	0	0	0	111.5	R547	G545-R547 VanDerWaalsContact C-N 3.26Å; G545-R547 PolarHBondContact O-N 3.33Å
546	L	28.5	Very low	32.5	Very low	188 Å²	188	161 Å²	161	98%	0.984	84%	0.835	S	S	*	*			trans	-77.4	72.2	179.7	-81.3	170.2	0	0	0	111.7	W548	L546-W548 PolarHBondContact O-N 3.33Å
547	R	28	Very low	32.7	Very low	194 Å²	194	157.9 Å²	157.9	73%	0.732	82%	0.822	S	S	*	*			trans	-85.5	102	175.8	-167.8	177.3	-164.4	166.2	7.6	110.7	G545 R549	G545-R547 VanDerWaalsContact C-N 3.26Å; G545-R547 PolarHBondContact O-N 3.33Å; R547-R549 PolarHBondContact O-N 2.89Å
548	W	25.9	Very low	32.7	Very low	251 Å²	251	160.9 Å²	160.9	95%	0.951	82%	0.819	S	S	*	*			trans	-59.7	117.6	165.4	-106.7	60.8	0	0	0	110	L546	L546-W548 PolarHBondContact O-N 3.33Å
549	R	29.3	Very low	32.7	Very low	197 Å²	197	164 Å²	164	74%	0.743	82%	0.823	S	S	*	*			trans	-146.7	146.2	165.2	-107.6	-175.6	173.9	-176.7	-3.7	109.7	R547	R547-R549 PolarHBondContact O-N 2.89Å
550	N	30.4	Very low	32.3	Very low	165 Å²	165	165.4 Å²	165.4	88%	0.882	83%	0.829	S	S	*	*			trans	-57.3	139.9	-172.9	-74.1	-20	0	0	0	112.9
551	S	30.1	Very low	32.1	Very low	112 Å²	112	161.5 Å²	161.5	78%	0.783	83%	0.826	S	S	*	*			trans	-141.6	105.9	165.8	-172.7	0	0	0	0	111.5
552	R	31.7	Very low	31.9	Very low	243 Å²	243	161.9 Å²	161.9	92%	0.917	83%	0.83	S	S	*	*				-152.5	108.5	124.5	-105.6	176.4	-166.1	-144.1	-0.5	108.4
553	R	31.5	Very low	31.6	Very low	212 Å²	212	162.3 Å²	162.3	80%	0.8	83%	0.827	S	S	*	*			trans	-73.5	150.1	160.1	-59.7	178.5	-174.9	169.7	0.3	108
554	V	37.2	Very low	31.7	Very low	144 Å²	144	159.9 Å²	159.9	87%	0.873	82%	0.822	S	S	*	*			trans	-119.6	128.9	142.4	-180	0	0	0	0	104.9
555	N	35.3	Very low	31.9	Very low	114 Å²	114	155.2 Å²	155.2	61%	0.61	82%	0.816	S	S	*	*			trans	-84.4	136.6	179.6	-60.5	-15.3	0	0	0	109.1
556	N	34.9	Very low	31.9	Very low	169 Å²	169	160.3 Å²	160.3	90%	0.904	82%	0.822	S	S	*	*				-150.2	162.6	126.6	-103.7	-16.7	0	0	0	109.1
557	V	38.1	Very low	32.3	Very low	115 Å²	115	156 Å²	156	70%	0.697	81%	0.805	S	S	*	*			trans	-128.4	153.7	-157.2	174.4	0	0	0	0	110.3
558	N	34.5	Very low	32.1	Very low	146 Å²	146	153.2 Å²	153.2	78%	0.781	81%	0.805	S	S	*	*			trans	77.7	141.2	-172.5	-49.6	-41.2	0	0	0	113.4
559	L	34.1	Very low	32.3	Very low	153 Å²	153	147.9 Å²	147.9	80%	0.801	80%	0.804	S	S	*	*			cis	-140.6	172.2	-0.7	-160.4	58.9	0	0	0	111
560	L	30.7	Very low	32.2	Very low	169 Å²	169	145.7 Å²	145.7	89%	0.885	80%	0.802	S	S	*	*			trans	-65.9	144.5	-178.3	-73.1	65.2	0	0	0	112.9
561	G	32.5	Very low	32	Very low	73 Å²	73	144.6 Å²	144.6	75%	0.753	80%	0.795	S	S	*	*			trans	169.6	123.3	169.1	0	0	0	0	0	109.7
562	G	30.2	Very low	32	Very low	88 Å²	88	144.9 Å²	144.9	91%	0.907	80%	0.795	S	S	*	*			trans	-101.1	90.2	-169.4	0	0	0	0	0	114.4
563	D	29	Very low	31.7	Very low	148 Å²	148	142 Å²	142	79%	0.791	79%	0.792	S	S	*	*			trans	-86	162.5	159.1	-71.7	-52.8	0	0	0	110.2
564	L	33.6	Very low	31.7	Very low	159 Å²	159	136.7 Å²	136.7	83%	0.832	79%	0.787	S	S	*	*			cis	-125	137	12.7	-71.3	71.2	0	0	0	112
565	N	34.1	Very low	31.2	Very low	152 Å²	152	137 Å²	137	81%	0.813	78%	0.779	S	S	*	*			trans	-105.2	123.4	151.1	-87.4	-33.5	0	0	0	109.1
566	Q	29.6	Very low	31	Very low	175 Å²	175	142 Å²	142	82%	0.818	80%	0.795	S	S	*	*			trans	63.4	-173.4	149.8	-146.8	154.7	-4.8	0	0	114.7
567	P	37	Very low	30.7	Very low	96 Å²	96	141.5 Å²	141.5	62%	0.623	79%	0.792	S	S	*	*			cis	-104.4	177.1	-43.7	4.7	18.4	0	0	0	114
568	D	25.2	Very low	30.4	Very low	137 Å²	137	140 Å²	140	73%	0.733	79%	0.791	S	S	*	*			trans	29.8	120.2	138.7	-48.1	-34	0	0	0	120.9
569	C	28.5	Very low	30.1	Very low	139 Å²	139	139.8 Å²	139.8	94%	0.939	79%	0.79	S	S	*	*			trans	-133.8	112.6	150.7	-139.3	0	0	0	0	110.4
570	H	28.2	Very low	30.1	Very low	150 Å²	150	139.4 Å²	139.4	69%	0.694	79%	0.789	S	S	*	*			trans	-67.6	158.2	-172.1	-86.8	-108.2	0	0	0	114.8
571	I	25.8	Very low	30.2	Very low	143 Å²	143	138.2 Å²	138.2	73%	0.733	78%	0.784	S	S	*	*			trans	51.3	114.1	137.7	-61.5	165.4	0	0	0	117.8
572	C	30.1	Very low	30.3	Very low	117 Å²	117	140.5 Å²	140.5	79%	0.791	78%	0.783	S	S	*	*				-172.1	108.8	117	-113.4	0	0	0	0	112.2
573	Q	26.2	Very low	30.5	Very low	183 Å²	183	142.6 Å²	142.6	86%	0.855	77%	0.774	S	S	*	*			trans	-101.1	106.2	158.9	175.3	172.8	-28	0	0	107.3
574	S	31.1	Very low	30.7	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	77%	0.769	S	S	*	*			trans	-113	128.7	-179.3	57.9	0	0	0	0	111.1
575	H	27.4	Very low	30.8	Very low	150 Å²	150	142.9 Å²	142.9	69%	0.694	77%	0.77	S	S	*	*			trans	-66.8	152.1	-175.7	-75.1	-144.1	0	0	0	113.2
576	F	30.6	Very low	31	Very low	219 Å²	219	139.9 Å²	139.9	96%	0.961	77%	0.766	S	S	*	*			trans	-137.5	65.7	151	-102.2	-77.4	0	0	0	109.9
577	L	29.2	Very low	31	Very low	160 Å²	160	139.1 Å²	139.1	84%	0.838	77%	0.768	S	S	*	*	S	Bend	trans	-129.4	146.7	155.7	-94.7	172.2	0	0	0	107.3
578	A	31.2	Very low	30.8	Very low	82 Å²	82	143.2 Å²	143.2	68%	0.678	78%	0.783	S	S	*	*			trans	-80.9	150.4	-168.1	0	0	0	0	0	113.3
579	D	28.1	Very low	31.3	Very low	142 Å²	142	142.3 Å²	142.3	76%	0.759	79%	0.788	S	S	*	*			trans	57.5	146.1	155.1	-54.3	-29.4	0	0	0	121.2
580	N	33.4	Very low	31.6	Very low	146 Å²	146	141.1 Å²	141.1	78%	0.781	78%	0.781	S	S	*	*			trans	72.1	98.1	163	-54.4	-47.3	0	0	0	118.7
581	N	33	Very low	32	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	77%	0.771	S	S	*	*				39.8	130.8	128.4	-63.4	-9.3	0	0	0	121.8
582	T	34.9	Very low	33	Very low	121 Å²	121	135.7 Å²	135.7	74%	0.742	77%	0.77	S	S	*	*			trans	69.7	119.7	144.4	48.2	0	0	0	0	120.5
583	D	35.1	Very low	33.8	Very low	132 Å²	132	135.1 Å²	135.1	71%	0.706	76%	0.763	S	S	*	*			trans	76	94.6	136.4	-58.2	-20	0	0	0	122.6
584	N	33.1	Very low	34.5	Very low	131 Å²	131	129 Å²	129	70%	0.701	74%	0.744	S	S	*	*				78.7	135.7	119	-62.7	-46.3	0	0	0	123
585	H	36	Very low	35.1	Very low	183 Å²	183	127.2 Å²	127.2	85%	0.847	74%	0.735	S	S	*	*			trans	83.9	134.2	152	-69.9	-56.7	0	0	0	123.5
586	A	36.6	Very low	36.1	Very low	88 Å²	88	122.8 Å²	122.8	73%	0.727	73%	0.725	S	S	*	*			trans	87.7	91.9	141.7	0	0	0	0	0	121.6
587	N	30.6	Very low	36.8	Very low	160 Å²	160	116.7 Å²	116.7	86%	0.856	70%	0.698	S	S	*	*				27.1	123.1	126.4	-60.7	-10.9	0	0	0	120.5
588	L	33.4	Very low	37.7	Very low	181 Å²	181	111.6 Å²	111.6	95%	0.948	68%	0.676	S	S	*	*			trans	-143.1	146.1	141.5	-143.1	73.9	0	0	0	111.1
589	S	34.6	Very low	38.7	Very low	119 Å²	119	110.3 Å²	110.3	83%	0.832	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-88.6	131	-165.3	55.8	0	0	0	0	114.7
590	S	35.5	Very low	39.8	Very low	114 Å²	114	110.6 Å²	110.6	80%	0.797	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-78.5	140.7	170	58.6	0	0	0	0	112.9
591	S	37	Very low	40.7	Very low	68 Å²	68	104.1 Å²	104.1	48%	0.476	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-75.1	154.7	-172.5	55.9	0	0	0	0	115.2	T593 A594	S591-T593 PolarHBondContact O-N 2.87Å; S591-T593 VanDerWaalsContact O-N 3.15Å; S591-T593 PolarHBondContact OG-OG1 3.1Å; S591-A594 PolarHBondContact O-N 2.85Å
592	P	45	Very low	41.5	Very low	111 Å²	111	106.1 Å²	106.1	72%	0.721	62%	0.622	S	S	*	*	H	α-helix	trans	-64.8	-18.8	-178.5	25.2	-35.2	0	0	0	114.5	A594 A595 A596	P592-A594 VanDerWaalsContact C-N 3.3Å; P592-A594 PolarHBondContact O-N 3.48Å; P592-A595 PolarHBondContact O-N 2.92Å; P592-A596 PolarHBondContact O-N 3.47Å
593	T	48.1	Very low	42.2	Very low	105 Å²	105	109 Å²	109	64%	0.644	63%	0.627	S	S	*	*	H	α-helix	trans	-64.9	-33.1	175.4	48.8	0	0	0	0	112.4	S591 F597	S591-T593 PolarHBondContact O-N 2.87Å; S591-T593 VanDerWaalsContact O-N 3.15Å; S591-T593 PolarHBondContact OG-OG1 3.1Å; T593-F597 WeakPolarHBondContact O-CB 3.39Å; T593-F597 PolarHBondContact O-N 3.36Å; T593-F597 VanDerWaalsContact O-N 3.08Å
594	A	41.4	Very low	42.6	Very low	55 Å²	55	105.6 Å²	105.6	46%	0.455	61%	0.607	S	S	.	*	H	α-helix	trans	-67.8	-36.8	175.1	0	0	0	0	0	112.2	S591 P592 F597 S598	S591-A594 PolarHBondContact O-N 2.85Å; P592-A594 VanDerWaalsContact C-N 3.3Å; P592-A594 PolarHBondContact O-N 3.48Å; A594-F597 PolarHBondContact O-N 2.86Å; A594-S598 PolarHBondContact O-N 2.86Å
595	A	42	Very low	43.3	Very low	61 Å²	61	104.7 Å²	104.7	50%	0.504	60%	0.598	S	S	.	*	H	α-helix	trans	-64	-47.7	176	0	0	0	0	0	111.3	P592 F597 S598 A599	P592-A595 PolarHBondContact O-N 2.92Å; A595-F597 PolarHBondContact O-N 3.46Å; A595-S598 PolarHBondContact O-N 3.19Å; A595-S598 PolarHBondContact O-OG 3.12Å; A595-A599 PolarHBondContact O-N 2.75Å
596	A	48.4	Very low	43.5	Very low	58 Å²	58	102.9 Å²	102.9	48%	0.479	59%	0.594	S	S	.	*	H	α-helix	trans	-60	-42.4	176.4	0	0	0	0	0	112.7	P592 S598 A599 F600	P592-A596 PolarHBondContact O-N 3.47Å; A596-S598 VanDerWaalsContact C-N 3.34Å; A596-S598 PolarHBondContact O-N 3.43Å; A596-A599 PolarHBondContact O-N 3.19Å; A596-F600 PolarHBondContact O-N 3.18Å; A596-F600 VanDerWaalsContact O-N 3.09Å
597	F	47.2	Very low	43.7	Very low	90 Å²	90	102.2 Å²	102.2	40%	0.395	58%	0.583	S	S	.	*	H	α-helix	trans	-57.3	-45.9	174.3	-174.3	-84.4	0	0	0	111.5	T335 I338 T593 A594 A595 A599 C601	T335-F597 HydrophobicContact CG2-CE2 4.37Å; T335-F597 HydrophobicContact CG2-CZ 4.34Å; I338-F597 HydrophobicContact CD1-CD2 3.44Å; I338-F597 VanDerWaalsContact CD1-CD2 3.44Å; I338-F597 HydrophobicContact CD1-CE2 3.45Å; I338-F597 VanDerWaalsContact CD1-CE2 3.45Å; T593-F597 WeakPolarHBondContact O-CB 3.39Å; T593-F597 PolarHBondContact O-N 3.36Å; T593-F597 VanDerWaalsContact O-N 3.08Å; A594-F597 PolarHBondContact O-N 2.86Å; A595-F597 PolarHBondContact O-N 3.46Å; F597-A599 PolarHBondContact O-N 3.21Å; F597-C601 PolarHBondContact O-N 3.28Å; F597-C601 PolarHBondContact O-SG 3.09Å
598	S	46.6	Very low	44.1	Very low	54 Å²	54	97 Å²	97	38%	0.378	56%	0.559	S	S	.	*	H	α-helix	trans	-64.7	-37.1	178.6	81	0	0	0	0	113.1	A594 A595 A596 R602	A594-S598 PolarHBondContact O-N 2.86Å; A595-S598 PolarHBondContact O-N 3.19Å; A595-S598 PolarHBondContact O-OG 3.12Å; A596-S598 VanDerWaalsContact C-N 3.34Å; A596-S598 PolarHBondContact O-N 3.43Å; S598-R602 WeakPolarHBondContact O-CG 3.37Å; S598-R602 PolarHBondContact O-N 3.15Å; S598-R602 VanDerWaalsContact O-N 3.11Å
599	A	52	Low	44.3	Very low	54 Å²	54	93.6 Å²	93.6	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-69.5	-46.4	-179.1	0	0	0	0	0	112.1	A595 A596 F597 C601 R602	A595-A599 PolarHBondContact O-N 2.75Å; A596-A599 PolarHBondContact O-N 3.19Å; F597-A599 PolarHBondContact O-N 3.21Å; A599-C601 VanDerWaalsContact C-N 3.35Å; A599-C601 PolarHBondContact O-N 3.5Å; A599-R602 PolarHBondContact O-N 3.33Å
600	F	50.9	Low	44.4	Very low	148 Å²	148	92.9 Å²	92.9	65%	0.649	55%	0.546	S	S	*	.	H	α-helix	trans	-64.3	-37.6	178.8	-109.8	-87.6	0	0	0	112.6	A596	A596-F600 PolarHBondContact O-N 3.18Å; A596-F600 VanDerWaalsContact O-N 3.09Å
601	C	53.6	Low	44.3	Very low	11 Å²	11	92.7 Å²	92.7	7%	0.074	54%	0.535	C	S	.	.	H	α-helix	trans	-70.8	-37.8	176.5	-70.4	0	0	0	0	113.3	C334 F597 A599 H603 Q604	C334-C601 WeakPolarHBondContact CB-SG 3.3Å; C334-C601 VanDerWaalsContact SG-CA 3.54Å; C334-C601 WeakPolarHBondContact SG-CB 3.35Å; C334-C601 CovalentContact SG-SG 2.04Å; C334-C601 PolarHBondContact SG-SG 3.36Å; F597-C601 PolarHBondContact O-N 3.28Å; F597-C601 PolarHBondContact O-SG 3.09Å; A599-C601 VanDerWaalsContact C-N 3.35Å; A599-C601 PolarHBondContact O-N 3.5Å; C601-H603 PolarHBondContact O-N 3.22Å; C601-H603 VanDerWaalsContact O-N 3.11Å; C601-Q604 PolarHBondContact O-N 3.32Å
602	R	48.9	Very low	44.3	Very low	184 Å²	184	95.6 Å²	95.6	69%	0.694	55%	0.55	S	S	*	.	H	α-helix	trans	-55.1	-32.5	-178.3	-87.7	177.9	178.4	-175.4	1.3	113.6	S598 A599 Q604 H605	S598-R602 WeakPolarHBondContact O-CG 3.37Å; S598-R602 PolarHBondContact O-N 3.15Å; S598-R602 VanDerWaalsContact O-N 3.11Å; A599-R602 PolarHBondContact O-N 3.33Å; R602-Q604 VanDerWaalsContact C-N 3.27Å; R602-Q604 PolarHBondContact O-N 3.42Å; R602-H605 WeakPolarHBondContact O-CB 3.31Å; R602-H605 PolarHBondContact O-CD2 3.48Å; R602-H605 PolarHBondContact O-N 3.42Å
603	H	49.1	Very low	44.1	Very low	182 Å²	182	95.2 Å²	95.2	84%	0.843	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-6.3	178.4	-85.9	-63.7	0	0	0	115.4	C601 H605	C601-H603 PolarHBondContact O-N 3.22Å; C601-H603 VanDerWaalsContact O-N 3.11Å; H603-H605 VanDerWaalsContact C-N 3.25Å; H603-H605 PolarHBondContact O-N 3.48Å
604	Q	45.3	Very low	43.2	Very low	60 Å²	60	100.3 Å²	100.3	28%	0.28	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.5	16.1	172.2	-59.6	-159	8.3	0	0	114	C601 R602 L606	C601-Q604 PolarHBondContact O-N 3.32Å; R602-Q604 VanDerWaalsContact C-N 3.27Å; R602-Q604 PolarHBondContact O-N 3.42Å; Q604-L606 PolarHBondContact O-N 3.21Å
605	H	47.1	Very low	42.7	Very low	112 Å²	112	105.4 Å²	105.4	52%	0.519	58%	0.577	S	S	.	*			trans	-66.3	60.3	179.6	-101.9	-127.8	0	0	0	115	R602 H603 S608	R602-H605 WeakPolarHBondContact O-CB 3.31Å; R602-H605 PolarHBondContact O-CD2 3.48Å; R602-H605 PolarHBondContact O-N 3.42Å; H603-H605 VanDerWaalsContact C-N 3.25Å; H603-H605 PolarHBondContact O-N 3.48Å; H605-S608 VanDerWaalsContact CE1-CB 3.47Å; H605-S608 WeakPolarHBondContact CE1-CB 3.23Å; H605-S608 PolarHBondContact CE1-OG 3.47Å; H605-S608 PolarHBondContact ND1-OG 3.3Å; H605-S608 PolarHBondContact NE2-OG 3.43Å
606	L	40.2	Very low	42.4	Very low	146 Å²	146	109.3 Å²	109.3	76%	0.764	59%	0.59	S	S	*	*	S	Bend	trans	-93.7	2.4	176.4	-85.5	162.3	0	0	0	114.2	Q604	Q604-L606 PolarHBondContact O-N 3.21Å
607	C	40.5	Very low	41.7	Very low	73 Å²	73	111.3 Å²	111.3	49%	0.493	60%	0.596	S	S	.	*	S	Bend	trans	-139	-12.3	-179.1	-73.8	0	0	0	0	115.3
608	S	39.9	Very low	41.1	Very low	50 Å²	50	115.7 Å²	115.7	35%	0.35	62%	0.617	S	S	.	*			trans	-92.8	-9.1	-166.6	-14.2	0	0	0	0	115.1	H605 S610	H605-S608 VanDerWaalsContact CE1-CB 3.47Å; H605-S608 WeakPolarHBondContact CE1-CB 3.23Å; H605-S608 PolarHBondContact CE1-OG 3.47Å; H605-S608 PolarHBondContact ND1-OG 3.3Å; H605-S608 PolarHBondContact NE2-OG 3.43Å; S608-S610 PolarHBondContact O-N 3.29Å
609	S	36.9	Very low	40.5	Very low	110 Å²	110	120.4 Å²	120.4	77%	0.769	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	19.4	-170.3	52.4	0	0	0	0	115.7
610	S	35.7	Very low	39.5	Very low	105 Å²	105	125.8 Å²	125.8	73%	0.734	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.9	5.6	177.1	59.6	0	0	0	0	115.7	S608	S608-S610 PolarHBondContact O-N 3.29Å
611	I	34.6	Very low	38.7	Very low	109 Å²	109	123.7 Å²	123.7	56%	0.559	65%	0.647	S	S	*	*			trans	-137	79.6	-176.8	-48.4	-178.5	0	0	0	111.3
612	T	36.6	Very low	38.2	Very low	130 Å²	130	128 Å²	128	80%	0.798	67%	0.673	S	S	*	*			trans	-147.8	145.1	157.4	44.3	0	0	0	0	109
613	P	40.6	Very low	37.7	Very low	103 Å²	103	126 Å²	126	67%	0.669	68%	0.676	S	S	*	*			cis	-132.2	109	-19.5	34.4	-15.1	0	0	0	112.8	M615	P613-M615 VanDerWaalsContact C-N 3.28Å; P613-M615 HydrophobicContact CB-CG 4.35Å; P613-M615 PolarHBondContact O-N 3.43Å
614	F	29	Very low	37.2	Very low	211 Å²	211	124.2 Å²	124.2	93%	0.925	67%	0.673	S	S	*	*			trans	-91	68	158.6	-97.5	-78.9	0	0	0	110.3	N616	F614-N616 PolarHBondContact O-N 3.13Å
615	M	32.2	Very low	37.5	Very low	163 Å²	163	125.6 Å²	125.6	80%	0.803	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	73.8	172.4	-83.7	-68.8	-166.6	0	0	110.6	P613	P613-M615 VanDerWaalsContact C-N 3.28Å; P613-M615 HydrophobicContact CB-CG 4.35Å; P613-M615 PolarHBondContact O-N 3.43Å
616	N	35	Very low	37.5	Very low	143 Å²	143	125.7 Å²	125.7	77%	0.765	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.7	3	167	-129.8	-14.6	0	0	0	116.4	F614 H618	F614-N616 PolarHBondContact O-N 3.13Å; N616-H618 VanDerWaalsContact C-N 3.27Å; N616-H618 PolarHBondContact O-N 2.78Å; N616-H618 VanDerWaalsContact O-N 3.16Å
617	V	34.8	Very low	38.2	Very low	99 Å²	99	122.1 Å²	122.1	60%	0.6	67%	0.674	S	S	*	*			trans	-91.6	60.4	175.3	-161.2	0	0	0	0	110.9	N619 F620	V617-N619 PolarHBondContact O-N 3.34Å; V617-F620 HydrophobicContact CB-CD2 4.46Å; V617-F620 HydrophobicContact CG1-CD2 3.5Å; V617-F620 HydrophobicContact CG1-CE2 4Å; V617-F620 HydrophobicContact CG1-CG 4.4Å
618	H	33.2	Very low	39.3	Very low	183 Å²	183	121.9 Å²	121.9	85%	0.847	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	12.8	178.6	-111.3	41.3	0	0	0	114.6	N616	N616-H618 VanDerWaalsContact C-N 3.27Å; N616-H618 PolarHBondContact O-N 2.78Å; N616-H618 VanDerWaalsContact O-N 3.16Å
619	N	33.8	Very low	40.8	Very low	152 Å²	152	130 Å²	130	81%	0.813	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.3	15.9	-171.3	-121.6	-24.4	0	0	0	114.5	V617 N621	V617-N619 PolarHBondContact O-N 3.34Å; N619-N621 PolarHBondContact O-N 3.19Å
620	F	32.8	Very low	42.9	Very low	168 Å²	168	129.6 Å²	129.6	74%	0.737	69%	0.694	S	S	*	*			trans	-74.5	93.2	165.1	-105	-59.9	0	0	0	109.9	V617 V622	V617-F620 HydrophobicContact CB-CD2 4.46Å; V617-F620 HydrophobicContact CG1-CD2 3.5Å; V617-F620 HydrophobicContact CG1-CE2 4Å; V617-F620 HydrophobicContact CG1-CG 4.4Å; F620-V622 VanDerWaalsContact O-CG2 3.32Å; F620-V622 WeakPolarHBondContact O-CG2 3.38Å; F620-V622 PolarHBondContact O-N 3.39Å
621	N	32.9	Very low	45.2	Very low	103 Å²	103	126.8 Å²	126.8	55%	0.551	67%	0.67	S	S	*	*			trans	-65.8	91.8	174.3	-175	-0.2	0	0	0	110.7	N619 N623	N619-N621 PolarHBondContact O-N 3.19Å; N621-N623 PolarHBondContact O-N 2.91Å; N621-N623 VanDerWaalsContact O-N 3.14Å; N621-N623 VanDerWaalsContact OD1-CB 3.28Å; N621-N623 WeakPolarHBondContact OD1-CB 3.48Å; N621-N623 PolarHBondContact OD1-N 3.37Å; N621-N623 PolarHBondContact OD1-ND2 3.48Å; N621-N623 VanDerWaalsContact OD1-ND2 3.13Å
622	V	44.1	Very low	47.5	Very low	103 Å²	103	124 Å²	124	62%	0.624	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-66	-13.7	-176	-169.2	0	0	0	0	112.6	F620 N624 Y625	F620-V622 VanDerWaalsContact O-CG2 3.32Å; F620-V622 WeakPolarHBondContact O-CG2 3.38Å; F620-V622 PolarHBondContact O-N 3.39Å; V622-N624 PolarHBondContact O-N 2.94Å; V622-N624 VanDerWaalsContact O-N 3.15Å; V622-Y625 HydrophobicContact CG1-CD2 4.17Å; V622-Y625 PolarHBondContact O-N 3.27Å; V622-Y625 VanDerWaalsContact O-N 3.16Å
623	N	38.2	Very low	49.8	Very low	142 Å²	142	119.4 Å²	119.4	76%	0.759	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-63.6	-21.6	-176.7	-60.2	-30.9	0	0	0	113.6	N621 Y625	N621-N623 PolarHBondContact O-N 2.91Å; N621-N623 VanDerWaalsContact O-N 3.14Å; N621-N623 VanDerWaalsContact OD1-CB 3.28Å; N621-N623 WeakPolarHBondContact OD1-CB 3.48Å; N621-N623 PolarHBondContact OD1-N 3.37Å; N621-N623 PolarHBondContact OD1-ND2 3.48Å; N621-N623 VanDerWaalsContact OD1-ND2 3.13Å; N623-Y625 PolarHBondContact O-N 3.48Å
624	N	38.5	Very low	52.1	Low	144 Å²	144	118.1 Å²	118.1	77%	0.77	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-88.8	41.5	171.7	-81	-3.3	0	0	0	113.1	V622 P626	V622-N624 PolarHBondContact O-N 2.94Å; V622-N624 VanDerWaalsContact O-N 3.15Å; N624-P626 WeakPolarHBondContact O-CD 3.18Å
625	Y	50.6	Low	54.9	Low	88 Å²	88	109.3 Å²	109.3	35%	0.345	59%	0.585	S	S	.	*			trans	-73.1	117.9	155.4	-121.8	-85.5	0	0	0	108	F392 V622 N623 S627	F392-Y625 WeakPolarHBondContact CD1-OH 3.39Å; V622-Y625 HydrophobicContact CG1-CD2 4.17Å; V622-Y625 PolarHBondContact O-N 3.27Å; V622-Y625 VanDerWaalsContact O-N 3.16Å; N623-Y625 PolarHBondContact O-N 3.48Å; Y625-S627 VanDerWaalsContact C-N 3.27Å; Y625-S627 PolarHBondContact O-N 3.29Å
626	P	46.9	Very low	57.7	Low	115 Å²	115	104.2 Å²	104.2	75%	0.747	56%	0.563	S	S	*	*			trans	-67.8	94.7	164.9	28.7	-31.8	0	0	0	107.2	N624 S628	N624-P626 WeakPolarHBondContact O-CD 3.18Å; P626-S628 PolarHBondContact O-N 3.33Å
627	S	55.3	Low	60.3	Low	70 Å²	70	102.2 Å²	102.2	49%	0.49	55%	0.551	S	S	.	*			trans	-59.1	106	167.4	59.5	0	0	0	0	106.6	Y625 Y629	Y625-S627 VanDerWaalsContact C-N 3.27Å; Y625-S627 PolarHBondContact O-N 3.29Å; S627-Y629 PolarHBondContact O-N 3.33Å
628	S	63.2	Low	62.9	Low	68 Å²	68	99 Å²	99	48%	0.476	53%	0.531	S	S	.	.			trans	-57.6	135.4	-179.9	60.7	0	0	0	0	108.1	P626 C630 L631 T632	P626-S628 PolarHBondContact O-N 3.33Å; S628-C630 CarbonylContact O-C 3.57Å; S628-C630 PolarHBondContact O-N 3.36Å; S628-L631 PolarHBondContact O-N 3.49Å; S628-L631 WeakPolarHBondContact OG-CB 3.39Å; S628-L631 PolarHBondContact OG-N 3.33Å; S628-T632 PolarHBondContact O-N 2.57Å
629	Y	72.7	Confident	65.6	Low	222 Å²	222	91 Å²	91	87%	0.871	50%	0.495	S	S	*	.	H	α-helix	trans	-53.2	-29.6	-178.3	-67.5	-80.7	0	0	0	111.8	S627 G633	S627-Y629 PolarHBondContact O-N 3.33Å; Y629-G633 WeakPolarHBondContact O-CA 3.33Å; Y629-G633 PolarHBondContact O-N 2.93Å
630	C	81.1	Confident	68.3	Low	101 Å²	101	87.5 Å²	87.5	68%	0.682	48%	0.479	S	S	*	.	H	α-helix	trans	-60.2	-46.7	169.1	-179.5	0	0	0	0	114.3	S628 G633 L634	S628-C630 CarbonylContact O-C 3.57Å; S628-C630 PolarHBondContact O-N 3.36Å; C630-G633 PolarHBondContact O-N 3.46Å; C630-L634 WeakPolarHBondContact O-CB 3.4Å; C630-L634 PolarHBondContact O-N 3.48Å
631	L	82.4	Confident	71	Confident	46 Å²	46	82.4 Å²	82.4	24%	0.241	46%	0.463	C	S	.	.	H	α-helix	trans	-67.9	-43.9	-179.4	-173.8	75.7	0	0	0	111.5	F381 S628 L634 K635	F381-L631 HydrophobicContact CE1-CD1 4.35Å; F381-L631 HydrophobicContact CE2-CD1 3.76Å; F381-L631 HydrophobicContact CZ-CD1 3.42Å; F381-L631 VanDerWaalsContact CZ-CD1 3.42Å; F381-L631 HydrophobicContact CZ-CG 3.94Å; S628-L631 PolarHBondContact O-N 3.49Å; S628-L631 WeakPolarHBondContact OG-CB 3.39Å; S628-L631 PolarHBondContact OG-N 3.33Å; L631-L634 PolarHBondContact O-N 3.28Å; L631-K635 PolarHBondContact O-N 2.95Å
632	T	83.1	Confident	73.8	Confident	50 Å²	50	78.4 Å²	78.4	31%	0.307	44%	0.441	S	S	.	.	H	α-helix	trans	-67.1	-40.2	175.9	-54.4	0	0	0	0	110.9	S628 L634 K635 T636	S628-T632 PolarHBondContact O-N 2.57Å; T632-L634 VanDerWaalsContact C-N 3.31Å; T632-L634 PolarHBondContact O-N 3.28Å; T632-K635 WeakPolarHBondContact O-CB 3.49Å; T632-K635 PolarHBondContact O-N 2.94Å; T632-T636 PolarHBondContact O-N 3.11Å; T632-T636 PolarHBondContact O-OG1 3.41Å
633	G	86.6	Confident	76	Confident	33 Å²	33	77 Å²	77	34%	0.34	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-33.2	172.8	0	0	0	0	0	113.8	Y629 C630 T636 L637	Y629-G633 WeakPolarHBondContact O-CA 3.33Å; Y629-G633 PolarHBondContact O-N 2.93Å; C630-G633 PolarHBondContact O-N 3.46Å; G633-T636 WeakPolarHBondContact CA-OG1 3.48Å; G633-T636 PolarHBondContact O-OG1 3.18Å; G633-L637 VanDerWaalsContact O-CB 3.22Å; G633-L637 WeakPolarHBondContact O-CB 3.11Å; G633-L637 PolarHBondContact O-N 2.93Å
634	L	87.1	Confident	78.5	Confident	76 Å²	76	74.2 Å²	74.2	40%	0.398	42%	0.419	S	S	.	.	H	α-helix	trans	-76	-34.9	174.4	-175.6	56.4	0	0	0	112	F381 C630 L631 T632 L637 I638	F381-L634 HydrophobicContact CD2-CD2 3.79Å; F381-L634 HydrophobicContact CD2-CG 3.86Å; F381-L634 HydrophobicContact CE2-CB 3.98Å; F381-L634 HydrophobicContact CE2-CD2 3.76Å; F381-L634 HydrophobicContact CE2-CG 3.71Å; C630-L634 WeakPolarHBondContact O-CB 3.4Å; C630-L634 PolarHBondContact O-N 3.48Å; L631-L634 PolarHBondContact O-N 3.28Å; T632-L634 VanDerWaalsContact C-N 3.31Å; T632-L634 PolarHBondContact O-N 3.28Å; L634-L637 HydrophobicContact CD1-CD2 4.3Å; L634-I638 HydrophobicContact CD1-CD1 4.24Å; L634-I638 HydrophobicContact CD1-CG1 4.3Å; L634-I638 HydrophobicContact CG-CD1 4.19Å; L634-I638 WeakPolarHBondContact O-CD1 3.26Å; L634-I638 VanDerWaalsContact O-CG1 3.27Å; L634-I638 WeakPolarHBondContact O-CG1 3.48Å; L634-I638 PolarHBondContact O-N 2.99Å; L634-I638 VanDerWaalsContact O-N 3.1Å
635	K	89	Confident	80.9	Confident	27 Å²	27	71.1 Å²	71.1	12%	0.117	40%	0.401	C	S	.	.	H	α-helix	trans	-58.6	-52.4	167.8	-71.5	-166.4	-179.2	-171.3	0	110.7	L322 N325 F381 L631 T632 L637 I638 T639	L322-K635 HydrophobicContact CD1-CD 4.22Å; L322-K635 HydrophobicContact CD1-CG 4.11Å; L322-K635 HydrophobicContact CD2-CB 4.48Å; L322-K635 HydrophobicContact CD2-CG 4.41Å; L322-K635 HydrophobicContact CG-CD 4.17Å; L322-K635 HydrophobicContact CG-CG 4.17Å; L322-K635 WeakPolarHBondContact O-CE 3.06Å; L322-K635 PolarHBondContact O-NZ 3.34Å; N325-K635 PolarHBondContact OD1-NZ 3.3Å; F381-K635 HydrophobicContact CE1-CD 4.49Å; F381-K635 HydrophobicContact CE1-CG 3.79Å; F381-K635 HydrophobicContact CE2-CG 4.37Å; F381-K635 HydrophobicContact CZ-CD 4.5Å; F381-K635 HydrophobicContact CZ-CG 3.51Å; L631-K635 PolarHBondContact O-N 2.95Å; T632-K635 WeakPolarHBondContact O-CB 3.49Å; T632-K635 PolarHBondContact O-N 2.94Å; K635-L637 PolarHBondContact O-N 2.94Å; K635-I638 PolarHBondContact O-N 3.05Å; K635-T639 WeakPolarHBondContact O-CG2 3.47Å; K635-T639 PolarHBondContact O-N 3.26Å; K635-T639 PolarHBondContact O-OG1 3.33Å
636	T	89.7	Confident	82.8	Confident	56 Å²	56	67.7 Å²	67.7	34%	0.344	39%	0.39	S	S	.	.	H	α-helix	trans	-61.3	-45.6	-179.5	52.1	0	0	0	0	111.4	W323 T632 G633 I638 T639 V640	W323-T636 HydrophobicContact CH2-CG2 3.63Å; W323-T636 HydrophobicContact CZ2-CG2 3.97Å; T632-T636 PolarHBondContact O-N 3.11Å; T632-T636 PolarHBondContact O-OG1 3.41Å; G633-T636 WeakPolarHBondContact CA-OG1 3.48Å; G633-T636 PolarHBondContact O-OG1 3.18Å; T636-I638 PolarHBondContact O-N 3.37Å; T636-T639 WeakPolarHBondContact CA-OG1 3.34Å; T636-T639 PolarHBondContact O-N 3.43Å; T636-T639 VanDerWaalsContact O-N 3.14Å; T636-T639 PolarHBondContact O-OG1 3.38Å; T636-V640 WeakPolarHBondContact O-CB 3.43Å; T636-V640 WeakPolarHBondContact O-CG2 3.3Å; T636-V640 PolarHBondContact O-N 3.03Å
637	L	90.1	Very high	84.8	Confident	100 Å²	100	65.8 Å²	65.8	52%	0.524	38%	0.376	S	S	.	.	H	α-helix	trans	-54.7	-50.3	177.5	-178.2	63.9	0	0	0	112.2	G633 L634 K635 T639 V640 C641	G633-L637 VanDerWaalsContact O-CB 3.22Å; G633-L637 WeakPolarHBondContact O-CB 3.11Å; G633-L637 PolarHBondContact O-N 2.93Å; L634-L637 HydrophobicContact CD1-CD2 4.3Å; K635-L637 PolarHBondContact O-N 2.94Å; L637-T639 VanDerWaalsContact C-N 3.29Å; L637-T639 PolarHBondContact O-N 3.42Å; L637-V640 PolarHBondContact O-N 3.41Å; L637-C641 WeakPolarHBondContact O-CB 3.48Å; L637-C641 PolarHBondContact O-N 3.38Å; L637-C641 PolarHBondContact O-SG 3.34Å
638	I	89.2	Confident	86.3	Confident	32 Å²	32	67 Å²	67	16%	0.164	38%	0.376	C	S	.	.	H	α-helix	trans	-57.7	-44.2	178.4	-68.6	165.2	0	0	0	110.8	I378 F381 L634 K635 T636 F642	I378-I638 HydrophobicContact CD1-CG2 4.33Å; I378-I638 HydrophobicContact CG1-CG2 3.68Å; F381-I638 HydrophobicContact CB-CD1 4.11Å; F381-I638 HydrophobicContact CD2-CD1 3.85Å; F381-I638 HydrophobicContact CG-CD1 4.11Å; L634-I638 HydrophobicContact CD1-CD1 4.24Å; L634-I638 HydrophobicContact CD1-CG1 4.3Å; L634-I638 HydrophobicContact CG-CD1 4.19Å; L634-I638 WeakPolarHBondContact O-CD1 3.26Å; L634-I638 VanDerWaalsContact O-CG1 3.27Å; L634-I638 WeakPolarHBondContact O-CG1 3.48Å; L634-I638 PolarHBondContact O-N 2.99Å; L634-I638 VanDerWaalsContact O-N 3.1Å; K635-I638 PolarHBondContact O-N 3.05Å; T636-I638 PolarHBondContact O-N 3.37Å; I638-F642 PolarHBondContact O-N 3.06Å; I638-F642 VanDerWaalsContact O-N 3.08Å
639	T	89.9	Confident	87.5	Confident	16 Å²	16	64.6 Å²	64.6	10%	0.098	36%	0.357	C	S	.	.	H	α-helix	trans	-70.1	-39.3	-179.8	59.1	0	0	0	0	113.3	I319 L322 K635 T636 L637 F642 C643	I319-T639 HydrophobicContact CB-CG2 4.43Å; I319-T639 HydrophobicContact CD1-CG2 4.31Å; I319-T639 HydrophobicContact CG1-CG2 4.1Å; I319-T639 HydrophobicContact CG2-CG2 3.64Å; L322-T639 HydrophobicContact CD2-CG2 4.31Å; K635-T639 WeakPolarHBondContact O-CG2 3.47Å; K635-T639 PolarHBondContact O-N 3.26Å; K635-T639 PolarHBondContact O-OG1 3.33Å; T636-T639 WeakPolarHBondContact CA-OG1 3.34Å; T636-T639 PolarHBondContact O-N 3.43Å; T636-T639 VanDerWaalsContact O-N 3.14Å; T636-T639 PolarHBondContact O-OG1 3.38Å; L637-T639 VanDerWaalsContact C-N 3.29Å; L637-T639 PolarHBondContact O-N 3.42Å; T639-F642 PolarHBondContact O-N 2.93Å; T639-C643 PolarHBondContact O-N 2.99Å; T639-C643 PolarHBondContact O-SG 3.26Å
640	V	91.1	Very high	88.1	Confident	77 Å²	77	56 Å²	56	47%	0.467	32%	0.323	S	S	.	.	H	α-helix	trans	-66.4	-42.6	176.5	169.5	0	0	0	0	110.5	T636 L637 F642 C643 I644	T636-V640 WeakPolarHBondContact O-CB 3.43Å; T636-V640 WeakPolarHBondContact O-CG2 3.3Å; T636-V640 PolarHBondContact O-N 3.03Å; L637-V640 PolarHBondContact O-N 3.41Å; V640-F642 PolarHBondContact O-N 2.88Å; V640-C643 PolarHBondContact O-N 2.68Å; V640-I644 HydrophobicContact CG1-CD1 3.74Å; V640-I644 HydrophobicContact CG1-CG1 4.45Å; V640-I644 VanDerWaalsContact O-CG1 3.31Å; V640-I644 WeakPolarHBondContact O-CG1 3.34Å; V640-I644 PolarHBondContact O-N 3.44Å
641	C	90.4	Very high	88.3	Confident	62 Å²	62	56.5 Å²	56.5	42%	0.419	32%	0.318	S	S	.	.	H	α-helix	trans	-59.3	-44.4	173.9	-71.9	0	0	0	0	112	L637 I644 M645	L637-C641 WeakPolarHBondContact O-CB 3.48Å; L637-C641 PolarHBondContact O-N 3.38Å; L637-C641 PolarHBondContact O-SG 3.34Å; C641-I644 PolarHBondContact O-N 3.01Å; C641-M645 WeakPolarHBondContact O-CG 3.48Å; C641-M645 PolarHBondContact O-N 2.71Å
642	F	89.7	Confident	88.2	Confident	19 Å²	19	55.8 Å²	55.8	8%	0.083	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-43.7	175.6	179.9	-105.8	0	0	0	112.5	V315 I319 I638 T639 V640 I644 M645 S646	V315-F642 HydrophobicContact CB-CD1 4.41Å; V315-F642 HydrophobicContact CB-CD2 4.46Å; V315-F642 HydrophobicContact CB-CE1 3.81Å; V315-F642 HydrophobicContact CB-CE2 3.88Å; V315-F642 HydrophobicContact CB-CZ 3.51Å; V315-F642 HydrophobicContact CG1-CD1 3.7Å; V315-F642 HydrophobicContact CG1-CD2 3.7Å; V315-F642 HydrophobicContact CG1-CE1 3.61Å; V315-F642 HydrophobicContact CG1-CE2 3.63Å; V315-F642 HydrophobicContact CG1-CG 3.74Å; V315-F642 HydrophobicContact CG1-CZ 3.58Å; V315-F642 HydrophobicContact CG2-CE2 3.77Å; V315-F642 HydrophobicContact CG2-CZ 3.78Å; I319-F642 HydrophobicContact CD1-CB 4.17Å; I319-F642 HydrophobicContact CD1-CD1 3.52Å; I319-F642 HydrophobicContact CD1-CE1 4.32Å; I319-F642 HydrophobicContact CD1-CG 4.1Å; I638-F642 PolarHBondContact O-N 3.06Å; I638-F642 VanDerWaalsContact O-N 3.08Å; T639-F642 PolarHBondContact O-N 2.93Å; V640-F642 PolarHBondContact O-N 2.88Å; F642-I644 VanDerWaalsContact C-N 3.31Å; F642-I644 PolarHBondContact O-N 2.96Å; F642-M645 PolarHBondContact O-N 3.35Å; F642-S646 VanDerWaalsContact O-CB 3.32Å; F642-S646 WeakPolarHBondContact O-CB 3.48Å; F642-S646 PolarHBondContact O-N 3.2Å
643	C	90.8	Very high	87.9	Confident	72 Å²	72	53.9 Å²	53.9	49%	0.486	30%	0.304	S	S	.	.	H	α-helix	trans	-58	-42.5	176	-71.1	0	0	0	0	112	T639 V640 S646 T647	T639-C643 PolarHBondContact O-N 2.99Å; T639-C643 PolarHBondContact O-SG 3.26Å; V640-C643 PolarHBondContact O-N 2.68Å; C643-S646 PolarHBondContact O-N 3Å; C643-T647 WeakPolarHBondContact O-CG2 3.3Å; C643-T647 PolarHBondContact O-N 3.03Å; C643-T647 PolarHBondContact O-OG1 3.46Å
644	I	91.2	Very high	87.4	Confident	85 Å²	85	59.3 Å²	59.3	44%	0.436	32%	0.319	S	S	.	.	H	α-helix	trans	-65.8	-45.3	176.7	-68.7	166.5	0	0	0	111.5	V640 C641 F642 S646 T647 I648	V640-I644 HydrophobicContact CG1-CD1 3.74Å; V640-I644 HydrophobicContact CG1-CG1 4.45Å; V640-I644 VanDerWaalsContact O-CG1 3.31Å; V640-I644 WeakPolarHBondContact O-CG1 3.34Å; V640-I644 PolarHBondContact O-N 3.44Å; C641-I644 PolarHBondContact O-N 3.01Å; F642-I644 VanDerWaalsContact C-N 3.31Å; F642-I644 PolarHBondContact O-N 2.96Å; I644-S646 VanDerWaalsContact C-N 3.27Å; I644-S646 PolarHBondContact O-N 2.9Å; I644-T647 PolarHBondContact O-N 3.32Å; I644-T647 PolarHBondContact O-OG1 3.1Å; I644-T647 VanDerWaalsContact O-OG1 3.11Å; I644-I648 HydrophobicContact CG2-CD1 3.69Å; I644-I648 HydrophobicContact CG2-CG1 4.43Å; I644-I648 WeakPolarHBondContact O-CB 3.43Å; I644-I648 VanDerWaalsContact O-CG1 3.25Å; I644-I648 WeakPolarHBondContact O-CG1 3.25Å; I644-I648 PolarHBondContact O-N 2.64Å
645	M	89.4	Confident	86.7	Confident	78 Å²	78	59.3 Å²	59.3	38%	0.384	33%	0.329	S	S	.	.	H	α-helix	trans	-63.4	-35.5	176.4	-68	-50.3	-58.4	0	0	112	M370 C641 F642 Y649	M370-M645 HydrophobicContact CE-CE 3.91Å; M370-M645 HydrophobicContact CE-CG 4.1Å; C641-M645 WeakPolarHBondContact O-CG 3.48Å; C641-M645 PolarHBondContact O-N 2.71Å; F642-M645 PolarHBondContact O-N 3.35Å; M645-Y649 VanDerWaalsContact O-CB 3.3Å; M645-Y649 WeakPolarHBondContact O-CB 3.32Å; M645-Y649 PolarHBondContact O-N 3.24Å
646	S	89.4	Confident	85.6	Confident	16 Å²	16	59.9 Å²	59.9	11%	0.112	33%	0.333	C	S	.	.	H	α-helix	trans	-69.2	-45.7	176.2	-172	0	0	0	0	112.3	F642 C643 I644 Y649 W650	F642-S646 VanDerWaalsContact O-CB 3.32Å; F642-S646 WeakPolarHBondContact O-CB 3.48Å; F642-S646 PolarHBondContact O-N 3.2Å; C643-S646 PolarHBondContact O-N 3Å; I644-S646 VanDerWaalsContact C-N 3.27Å; I644-S646 PolarHBondContact O-N 2.9Å; S646-Y649 PolarHBondContact O-N 3.3Å; S646-W650 PolarHBondContact O-N 3.31Å
647	T	88.7	Confident	84.1	Confident	76 Å²	76	59.1 Å²	59.1	47%	0.466	34%	0.336	S	S	.	.	H	α-helix	trans	-65.6	-42.2	177.4	53.8	0	0	0	0	111.8	C643 I644 Y649 W650 I651	C643-T647 WeakPolarHBondContact O-CG2 3.3Å; C643-T647 PolarHBondContact O-N 3.03Å; C643-T647 PolarHBondContact O-OG1 3.46Å; I644-T647 PolarHBondContact O-N 3.32Å; I644-T647 PolarHBondContact O-OG1 3.1Å; I644-T647 VanDerWaalsContact O-OG1 3.11Å; T647-Y649 VanDerWaalsContact C-N 3.31Å; T647-Y649 PolarHBondContact O-N 3.1Å; T647-W650 PolarHBondContact O-N 3.24Å; T647-I651 VanDerWaalsContact O-CB 3.25Å; T647-I651 WeakPolarHBondContact O-CB 3.31Å; T647-I651 WeakPolarHBondContact O-CD1 3.18Å; T647-I651 WeakPolarHBondContact O-CG1 3.1Å; T647-I651 PolarHBondContact O-N 2.93Å
648	I	87.8	Confident	82.7	Confident	94 Å²	94	59.5 Å²	59.5	48%	0.482	34%	0.343	S	S	.	.	H	α-helix	trans	-57.9	-45.2	174	-68.6	168.1	0	0	0	110.7	I644 S652	I644-I648 HydrophobicContact CG2-CD1 3.69Å; I644-I648 HydrophobicContact CG2-CG1 4.43Å; I644-I648 WeakPolarHBondContact O-CB 3.43Å; I644-I648 VanDerWaalsContact O-CG1 3.25Å; I644-I648 WeakPolarHBondContact O-CG1 3.25Å; I644-I648 PolarHBondContact O-N 2.64Å; I648-S652 WeakPolarHBondContact O-CB 3.43Å; I648-S652 PolarHBondContact O-N 2.98Å; I648-S652 PolarHBondContact O-OG 3.24Å
649	Y	87.4	Confident	81.3	Confident	18 Å²	18	60.8 Å²	60.8	7%	0.071	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-52.2	177.9	178.9	-104.9	0	0	0	112.4	F363 W367 M645 S646 T647 I651 S652 I653	F363-Y649 AromaticContact CD1-CE2 4Å; F363-Y649 HydrophobicContact CD1-CE2 4Å; F363-Y649 HydrophobicContact CE1-CD2 4.1Å; F363-Y649 AromaticContact CE1-CE2 3.24Å; F363-Y649 HydrophobicContact CE1-CE2 3.24Å; F363-Y649 AromaticContact CE1-CZ 3.65Å; F363-Y649 HydrophobicContact CE2-CD2 4.24Å; F363-Y649 AromaticContact CE2-CE2 3.99Å; F363-Y649 HydrophobicContact CE2-CE2 3.99Å; F363-Y649 AromaticContact CZ-CD2 3.63Å; F363-Y649 HydrophobicContact CZ-CD2 3.63Å; F363-Y649 AromaticContact CZ-CE2 3.24Å; F363-Y649 HydrophobicContact CZ-CE2 3.24Å; W367-Y649 HydrophobicContact CB-CD2 4.32Å; W367-Y649 HydrophobicContact CB-CE1 4.31Å; W367-Y649 HydrophobicContact CB-CE2 3.55Å; W367-Y649 AromaticContact CD1-CE1 3.96Å; W367-Y649 AromaticContact CD1-CZ 3.89Å; W367-Y649 AromaticContact CD2-CD1 3.54Å; W367-Y649 HydrophobicContact CD2-CD1 3.54Å; W367-Y649 HydrophobicContact CD2-CD2 4.04Å; W367-Y649 AromaticContact CD2-CE1 3.38Å; W367-Y649 HydrophobicContact CD2-CE1 3.38Å; W367-Y649 AromaticContact CD2-CE2 3.9Å; W367-Y649 HydrophobicContact CD2-CE2 3.9Å; W367-Y649 AromaticContact CD2-CG 3.85Å; W367-Y649 HydrophobicContact CD2-CG 3.85Å; W367-Y649 AromaticContact CD2-CZ 3.57Å; W367-Y649 AromaticContact CE2-CD1 3.77Å; W367-Y649 AromaticContact CE2-CE1 3.58Å; W367-Y649 AromaticContact CE3-CD1 3.4Å; W367-Y649 HydrophobicContact CE3-CD1 3.4Å; W367-Y649 AromaticContact CE3-CD2 3.56Å; W367-Y649 HydrophobicContact CE3-CD2 3.56Å; W367-Y649 AromaticContact CE3-CE1 3.75Å; W367-Y649 HydrophobicContact CE3-CE1 3.75Å; W367-Y649 AromaticContact CE3-CE2 3.91Å; W367-Y649 HydrophobicContact CE3-CE2 3.91Å; W367-Y649 AromaticContact CE3-CG 3.27Å; W367-Y649 HydrophobicContact CE3-CG 3.27Å; W367-Y649 AromaticContact CE3-CZ 3.99Å; W367-Y649 HydrophobicContact CG-CD1 4.26Å; W367-Y649 HydrophobicContact CG-CD2 4.38Å; W367-Y649 AromaticContact CG-CE1 3.64Å; W367-Y649 HydrophobicContact CG-CE1 3.64Å; W367-Y649 AromaticContact CG-CE2 3.79Å; W367-Y649 HydrophobicContact CG-CE2 3.79Å; W367-Y649 AromaticContact CG-CZ 3.36Å; W367-Y649 AromaticContact CH2-CD1 3.76Å; W367-Y649 HydrophobicContact CH2-CD1 3.76Å; W367-Y649 HydrophobicContact CH2-CE1 4.41Å; W367-Y649 HydrophobicContact CH2-CG 4.17Å; W367-Y649 AromaticContact CZ2-CD1 3.88Å; W367-Y649 HydrophobicContact CZ2-CD1 3.88Å; W367-Y649 HydrophobicContact CZ2-CE1 4.1Å; W367-Y649 VanDerWaalsContact CZ3-CB 3.48Å; W367-Y649 AromaticContact CZ3-CD1 3.52Å; W367-Y649 HydrophobicContact CZ3-CD1 3.52Å; W367-Y649 HydrophobicContact CZ3-CD2 4.19Å; W367-Y649 HydrophobicContact CZ3-CE1 4.26Å; W367-Y649 AromaticContact CZ3-CG 3.46Å; W367-Y649 HydrophobicContact CZ3-CG 3.46Å; W367-Y649 VanDerWaalsContact CZ3-CG 3.46Å; W367-Y649 AromaticContact NE1-CE1 3.92Å; M645-Y649 VanDerWaalsContact O-CB 3.3Å; M645-Y649 WeakPolarHBondContact O-CB 3.32Å; M645-Y649 PolarHBondContact O-N 3.24Å; S646-Y649 PolarHBondContact O-N 3.3Å; T647-Y649 VanDerWaalsContact C-N 3.31Å; T647-Y649 PolarHBondContact O-N 3.1Å; Y649-I651 PolarHBondContact O-N 3.01Å; Y649-S652 PolarHBondContact O-N 3.44Å; Y649-S652 VanDerWaalsContact O-N 3.1Å; Y649-S652 PolarHBondContact O-OG 3.08Å; Y649-I653 HydrophobicContact CD1-CD1 3.95Å; Y649-I653 HydrophobicContact CE1-CD1 3.37Å; Y649-I653 HydrophobicContact CE1-CG1 4.44Å; Y649-I653 HydrophobicContact CE2-CD1 4.35Å; Y649-I653 PolarHBondContact O-N 3.02Å
650	W	86.2	Confident	80.1	Confident	42 Å²	42	62.1 Å²	62.1	16%	0.159	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-41.7	179.6	-75	114.1	0	0	0	112.6	L305 S308 M312 S646 T647 S652 I653 F654	L305-W650 HydrophobicContact CD1-CH2 3.77Å; L305-W650 HydrophobicContact CD1-CZ3 3.66Å; S308-W650 WeakPolarHBondContact OG-CH2 3.28Å; M312-W650 HydrophobicContact CE-CZ2 4.35Å; M312-W650 HydrophobicContact SD-CZ2 3.74Å; M312-W650 PolarHBondContact SD-NE1 3.39Å; S646-W650 PolarHBondContact O-N 3.31Å; T647-W650 PolarHBondContact O-N 3.24Å; W650-S652 VanDerWaalsContact C-N 3.27Å; W650-S652 PolarHBondContact O-N 3.44Å; W650-I653 HydrophobicContact CE3-CD1 3.85Å; W650-I653 HydrophobicContact CZ3-CD1 3.93Å; W650-I653 PolarHBondContact O-N 3.02Å; W650-I653 VanDerWaalsContact O-N 3.16Å; W650-F654 HydrophobicContact CB-CD2 4.44Å; W650-F654 HydrophobicContact CB-CE2 4.29Å; W650-F654 HydrophobicContact CE3-CE2 4.02Å; W650-F654 HydrophobicContact CE3-CZ 4.34Å; W650-F654 WeakPolarHBondContact O-CD2 3.33Å; W650-F654 PolarHBondContact O-N 3.36Å
651	I	85	Confident	78.8	Confident	112 Å²	112	66.8 Å²	66.8	57%	0.574	38%	0.375	S	S	*	.	H	α-helix	trans	-59	-41.1	172.7	-69.3	165.4	0	0	0	110.2	T647 Y649 I653 F654 A655	T647-I651 VanDerWaalsContact O-CB 3.25Å; T647-I651 WeakPolarHBondContact O-CB 3.31Å; T647-I651 WeakPolarHBondContact O-CD1 3.18Å; T647-I651 WeakPolarHBondContact O-CG1 3.1Å; T647-I651 PolarHBondContact O-N 2.93Å; Y649-I651 PolarHBondContact O-N 3.01Å; I651-I653 VanDerWaalsContact C-N 3.34Å; I651-I653 PolarHBondContact O-N 3.36Å; I651-F654 PolarHBondContact O-N 3.21Å; I651-A655 WeakPolarHBondContact O-CB 3.37Å; I651-A655 PolarHBondContact O-N 3.32Å
652	S	80.5	Confident	77.4	Confident	30 Å²	30	67.2 Å²	67.2	21%	0.21	38%	0.376	C	S	.	.	H	α-helix	trans	-66.5	-31.5	177.4	78.5	0	0	0	0	113.7	I648 Y649 W650 Q656	I648-S652 WeakPolarHBondContact O-CB 3.43Å; I648-S652 PolarHBondContact O-N 2.98Å; I648-S652 PolarHBondContact O-OG 3.24Å; Y649-S652 PolarHBondContact O-N 3.44Å; Y649-S652 VanDerWaalsContact O-N 3.1Å; Y649-S652 PolarHBondContact O-OG 3.08Å; W650-S652 VanDerWaalsContact C-N 3.27Å; W650-S652 PolarHBondContact O-N 3.44Å; S652-Q656 WeakPolarHBondContact O-CB 3.31Å; S652-Q656 WeakPolarHBondContact O-CG 3.37Å; S652-Q656 PolarHBondContact O-N 3.14Å; S652-Q656 PolarHBondContact O-NE2 2.97Å
653	I	77.3	Confident	76.2	Confident	10 Å²	10	66.3 Å²	66.3	5%	0.051	37%	0.372	C	S	.	.	H	α-helix	trans	-67.7	-53.7	171.2	-69.5	169.9	0	0	0	110.4	I231 I304 F363 Y649 W650 I651 A655 Q656 G657	I231-I653 HydrophobicContact CD1-CG1 4.32Å; I304-I653 HydrophobicContact CG2-CD1 3.77Å; I304-I653 HydrophobicContact CG2-CG1 4.24Å; F363-I653 HydrophobicContact CE1-CD1 4.13Å; F363-I653 HydrophobicContact CE1-CG1 3.67Å; F363-I653 HydrophobicContact CZ-CG1 3.9Å; Y649-I653 HydrophobicContact CD1-CD1 3.95Å; Y649-I653 HydrophobicContact CE1-CD1 3.37Å; Y649-I653 HydrophobicContact CE1-CG1 4.44Å; Y649-I653 HydrophobicContact CE2-CD1 4.35Å; Y649-I653 PolarHBondContact O-N 3.02Å; W650-I653 HydrophobicContact CE3-CD1 3.85Å; W650-I653 HydrophobicContact CZ3-CD1 3.93Å; W650-I653 PolarHBondContact O-N 3.02Å; W650-I653 VanDerWaalsContact O-N 3.16Å; I651-I653 VanDerWaalsContact C-N 3.34Å; I651-I653 PolarHBondContact O-N 3.36Å; I653-A655 PolarHBondContact O-N 2.97Å; I653-Q656 CarbonylContact O-C 3.6Å; I653-Q656 PolarHBondContact O-N 3.1Å; I653-G657 PolarHBondContact O-N 3.09Å; I653-G657 VanDerWaalsContact O-N 3.14Å
654	F	76.6	Confident	74.9	Confident	148 Å²	148	67.9 Å²	67.9	65%	0.649	38%	0.375	S	S	*	.	H	α-helix	trans	-67	-38.5	-174.5	-69.4	-60.2	0	0	0	112.4	W650 I651 Q656 G657	W650-F654 HydrophobicContact CB-CD2 4.44Å; W650-F654 HydrophobicContact CB-CE2 4.29Å; W650-F654 HydrophobicContact CE3-CE2 4.02Å; W650-F654 HydrophobicContact CE3-CZ 4.34Å; W650-F654 WeakPolarHBondContact O-CD2 3.33Å; W650-F654 PolarHBondContact O-N 3.36Å; I651-F654 PolarHBondContact O-N 3.21Å; F654-Q656 PolarHBondContact O-N 3.41Å; F654-G657 PolarHBondContact O-N 3.33Å
655	A	72.4	Confident	73.2	Confident	75 Å²	75	64.5 Å²	64.5	62%	0.62	36%	0.361	S	S	*	.	H	α-helix	trans	-67.6	-21.8	175.9	0	0	0	0	0	113.7	I651 I653	I651-A655 WeakPolarHBondContact O-CB 3.37Å; I651-A655 PolarHBondContact O-N 3.32Å; I653-A655 PolarHBondContact O-N 2.97Å
656	Q	65.7	Low	71.7	Confident	40 Å²	40	69.4 Å²	69.4	19%	0.187	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	3.2	176.3	-65.1	-178.5	50.1	0	0	113.2	H229 I231 S652 I653 F654 T658	H229-Q656 PolarHBondContact O-OE1 3.02Å; I231-Q656 HydrophobicContact CB-CB 4.07Å; I231-Q656 HydrophobicContact CD1-CB 4.34Å; I231-Q656 HydrophobicContact CG1-CB 4.32Å; S652-Q656 WeakPolarHBondContact O-CB 3.31Å; S652-Q656 WeakPolarHBondContact O-CG 3.37Å; S652-Q656 PolarHBondContact O-N 3.14Å; S652-Q656 PolarHBondContact O-NE2 2.97Å; I653-Q656 CarbonylContact O-C 3.6Å; I653-Q656 PolarHBondContact O-N 3.1Å; F654-Q656 PolarHBondContact O-N 3.41Å; Q656-T658 PolarHBondContact O-N 2.8Å
657	G	58.5	Low	70.3	Confident	40 Å²	40	70.6 Å²	70.6	41%	0.412	40%	0.395	S	S	.	.			trans	-75	6	-176.9	0	0	0	0	0	115.6	I653 F654 L659	I653-G657 PolarHBondContact O-N 3.09Å; I653-G657 VanDerWaalsContact O-N 3.14Å; F654-G657 PolarHBondContact O-N 3.33Å; G657-L659 PolarHBondContact O-N 2.89Å
658	T	59.4	Low	69	Low	108 Å²	108	72.5 Å²	72.5	66%	0.663	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-72.4	120.7	175.6	44.5	0	0	0	0	110.5	Q656	Q656-T658 PolarHBondContact O-N 2.8Å
659	L	61.2	Low	67.9	Low	58 Å²	58	68.9 Å²	68.9	30%	0.304	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-61.1	137.5	168.6	-81	73.5	0	0	0	108.4	Y272 G657 C663 L664	Y272-L659 HydrophobicContact CD2-CD2 3.66Å; Y272-L659 HydrophobicContact CE2-CD2 4.23Å; Y272-L659 HydrophobicContact CG-CD2 4.04Å; G657-L659 PolarHBondContact O-N 2.89Å; L659-C663 HydrophobicContact CB-CB 4.4Å; L659-C663 HydrophobicContact CD2-CB 4.28Å; L659-L664 HydrophobicContact CB-CD2 4.49Å; L659-L664 HydrophobicContact CB-CG 4.25Å
660	P	63.5	Low	67	Low	45 Å²	45	74.5 Å²	74.5	29%	0.292	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-64.6	148.3	174.3	28.8	-33.7	0	0	0	109.8	A233 V235 T662 C663 L664	A233-P660 HydrophobicContact CB-CG 4.46Å; V235-P660 HydrophobicContact CG2-CG 4.24Å; P660-T662 PolarHBondContact O-N 2.99Å; P660-C663 HydrophobicContact CG-CB 4.38Å; P660-C663 WeakPolarHBondContact O-CA 3.34Å; P660-C663 WeakPolarHBondContact O-CB 3.47Å; P660-C663 PolarHBondContact O-N 2.89Å; P660-L664 PolarHBondContact O-N 3.29Å
661	E	64.1	Low	65.9	Low	174 Å²	174	75.3 Å²	75.3	81%	0.813	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-28	-174.7	-63.8	170.8	170.6	0	0	113.1	C663 L664	E661-C663 VanDerWaalsContact C-N 3.26Å; E661-C663 PolarHBondContact O-N 2.67Å; E661-L664 CarbonylContact O-C 3.59Å; E661-L664 PolarHBondContact O-N 2.86Å; E661-L664 VanDerWaalsContact O-N 3.08Å
662	T	61.8	Low	64.8	Low	72 Å²	72	73.1 Å²	73.1	44%	0.442	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.5	173.3	53.2	0	0	0	0	114	S274 N295 P660	S274-T662 PolarHBondContact OG-O 3.41Å; N295-T662 PolarHBondContact ND2-O 2.98Å; P660-T662 PolarHBondContact O-N 2.99Å
663	C	64.4	Low	63.6	Low	0 Å²	0	79.4 Å²	79.4	0%	0	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-30.2	171.4	-60.2	0	0	0	0	111.6	Y272 S274 C297 L659 P660 E661 G665	Y272-C663 VanDerWaalsContact CD1-O 3.27Å; Y272-C663 WeakPolarHBondContact CD1-O 3.23Å; Y272-C663 WeakPolarHBondContact CE1-O 3.42Å; S274-C663 VanDerWaalsContact CB-O 3.29Å; S274-C663 WeakPolarHBondContact CB-O 3.39Å; S274-C663 PolarHBondContact OG-O 3.35Å; C297-C663 HydrophobicContact CB-CB 3.82Å; C297-C663 WeakPolarHBondContact CB-SG 3.36Å; C297-C663 VanDerWaalsContact SG-CA 3.54Å; C297-C663 WeakPolarHBondContact SG-CB 3.49Å; C297-C663 CovalentContact SG-SG 2.04Å; C297-C663 PolarHBondContact SG-SG 2.93Å; L659-C663 HydrophobicContact CB-CB 4.4Å; L659-C663 HydrophobicContact CD2-CB 4.28Å; P660-C663 HydrophobicContact CG-CB 4.38Å; P660-C663 WeakPolarHBondContact O-CA 3.34Å; P660-C663 WeakPolarHBondContact O-CB 3.47Å; P660-C663 PolarHBondContact O-N 2.89Å; E661-C663 VanDerWaalsContact C-N 3.26Å; E661-C663 PolarHBondContact O-N 2.67Å; C663-G665 PolarHBondContact O-N 3.06Å
664	L	61.8	Low	62.2	Low	105 Å²	105	83.9 Å²	83.9	55%	0.55	46%	0.461	S	S	.	.	S	Bend	trans	-77.6	37.7	174.7	-65	166.1	0	0	0	112.3	L659 P660 E661	L659-L664 HydrophobicContact CB-CD2 4.49Å; L659-L664 HydrophobicContact CB-CG 4.25Å; P660-L664 PolarHBondContact O-N 3.29Å; E661-L664 CarbonylContact O-C 3.59Å; E661-L664 PolarHBondContact O-N 2.86Å; E661-L664 VanDerWaalsContact O-N 3.08Å
665	G	57	Low	60.4	Low	14 Å²	14	83.8 Å²	83.8	14%	0.144	47%	0.468	C	S	.	.			trans	-68	156.4	-173.7	0	0	0	0	0	114	C663 S667	C663-G665 PolarHBondContact O-N 3.06Å; G665-S667 PolarHBondContact O-N 3.21Å
666	I	56.2	Low	58.4	Low	180 Å²	180	92 Å²	92	92%	0.923	48%	0.483	S	S	*	.	S	Bend	trans	-56.9	-26.7	-168.7	-59.8	165.2	0	0	0	113.5
667	S	60.2	Low	56.6	Low	41 Å²	41	99.4 Å²	99.4	29%	0.287	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.9	176.7	58.9	0	0	0	0	112.3	V275 G665	V275-S667 PolarHBondContact N-O 3.04Å; V275-S667 PolarHBondContact O-OG 3.15Å; G665-S667 PolarHBondContact O-N 3.21Å
668	L	62.4	Low	56.5	Low	116 Å²	116	102.4 Å²	102.4	61%	0.607	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	143.6	167.1	-94.2	155.3	0	0	0	109.7	Y272	Y272-L668 HydrophobicContact CD1-CD2 4.19Å; Y272-L668 HydrophobicContact CE1-CD2 3.55Å; Y272-L668 HydrophobicContact CE1-CG 4.04Å; Y272-L668 HydrophobicContact CE2-CD2 4.05Å
669	C	65.4	Low	56.3	Low	18 Å²	18	102.1 Å²	102.1	12%	0.122	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-73.6	141.4	175.1	-58.7	0	0	0	0	112	C260 L273	C260-C669 HydrophobicContact CB-CB 3.62Å; C260-C669 WeakPolarHBondContact CB-SG 3.3Å; C260-C669 WeakPolarHBondContact O-CA 3.09Å; C260-C669 WeakPolarHBondContact SG-CB 3.27Å; C260-C669 CovalentContact SG-SG 2.03Å; C260-C669 PolarHBondContact SG-SG 3.5Å; L273-C669 HydrophobicContact CD2-CB 4.12Å; L273-C669 WeakPolarHBondContact CD2-SG 3.42Å; L273-C669 VanDerWaalsContact CG-SG 3.52Å
670	Q	67.3	Low	56.1	Low	136 Å²	136	104.5 Å²	104.5	64%	0.636	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86	138.7	175.2	-177.9	171.3	-18.2	0	0	110.3	C260 L261 L262	C260-Q670 PolarHBondContact O-N 2.89Å; L261-Q670 CarbonylContact C-O 3.54Å; L261-Q670 WeakPolarHBondContact CA-O 3.33Å; L262-Q670 PolarHBondContact N-O 2.98Å
671	I	62.5	Low	55.6	Low	60 Å²	60	108 Å²	108	31%	0.308	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.4	132.6	175.7	-58.8	152.1	0	0	0	108.9	N264 E673	N264-I671 VanDerWaalsContact OD1-CG2 3.28Å; N264-I671 WeakPolarHBondContact OD1-CG2 3.39Å; I671-E673 PolarHBondContact O-N 2.95Å
672	I	63.7	Low	55.1	Low	66 Å²	66	103.9 Å²	103.9	34%	0.338	55%	0.552	S	S	.	*			trans	-78.5	109.9	163.7	-59.3	166.8	0	0	0	107.2	L261 L262 T674	L261-I672 HydrophobicContact CB-CD1 3.76Å; L261-I672 HydrophobicContact CB-CG1 3.83Å; L261-I672 HydrophobicContact CD1-CD1 4.2Å; L261-I672 HydrophobicContact CD1-CG1 4.33Å; L261-I672 HydrophobicContact CD2-CG1 4.18Å; L261-I672 HydrophobicContact CG-CD1 4.48Å; L261-I672 HydrophobicContact CG-CG1 4.34Å; L262-I672 PolarHBondContact O-N 2.88Å; I672-T674 HydrophobicContact CG2-CG2 4.14Å; I672-T674 PolarHBondContact O-N 3.18Å; I672-T674 VanDerWaalsContact O-N 3.08Å
673	E	54.6	Low	54.7	Low	162 Å²	162	106 Å²	106	76%	0.757	56%	0.559	S	S	*	*			trans	-65.9	106.7	156.3	-71.5	-170	169.9	0	0	108	I671 N675	I671-E673 PolarHBondContact O-N 2.95Å; E673-N675 PolarHBondContact O-N 3.43Å
674	T	48.4	Very low	54	Low	104 Å²	104	113.6 Å²	113.6	64%	0.638	60%	0.599	S	S	*	*			trans	-73.4	67.2	-179.5	51.2	0	0	0	0	110.6	I672	I672-T674 HydrophobicContact CG2-CG2 4.14Å; I672-T674 PolarHBondContact O-N 3.18Å; I672-T674 VanDerWaalsContact O-N 3.08Å
675	N	37.1	Very low	53.4	Low	146 Å²	146	114.2 Å²	114.2	78%	0.781	60%	0.603	S	S	*	*			trans	-121.6	26.7	-178.6	-144.5	5.2	0	0	0	111.4	E673	E673-N675 PolarHBondContact O-N 3.43Å
676	R	31.1	Very low	53	Low	248 Å²	248	122.6 Å²	122.6	94%	0.936	64%	0.641	S	S	*	*			trans	-127.5	86.3	168.1	-91.6	-175.9	166.2	166.9	-3.8	109
677	S	27.7	Very low	52.8	Low	194 Å²	194	117.4 Å²	117.4	100%	1.357	62%	0.615	S	S	*	*			trans	-82.3	0	151.2	57.8	0	0	0	0	109.1

Retrieved 677 of 677 residues in 861.3 ms (Link to these results)

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